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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Identification

Display Name:
Fir, Abies sibirica, ext.
EC Number:
294-351-9
EC Name:
Fir, Abies sibirica, ext.
CAS Number:
91697-89-1
Molecular formula:
not applicable
IUPAC Name:
Essential oil of Abies sibirica Ledeb. (Pinaceae) obtained from needles and branches by distillation.

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers open all close all

  • 8021-29-2
  • Fir needle oil
  • Compositions

    Boundary Composition(s) open all close all

    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    Dipentene
    EC Number:
    205-341-0
    EC Name:
    Dipentene
    CAS Number:
    138-86-3
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropenyl-1-methylcyclohexene
    Constituent 2
    Chemical structure
    Reference substance name:
    Pin-2(3)-ene
    EC Number:
    201-291-9
    EC Name:
    Pin-2(3)-ene
    CAS Number:
    80-56-8
    Molecular formula:
    C10H16
    IUPAC Name:
    2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
    Constituent 3
    Chemical structure
    Reference substance name:
    Pin-2(10)-ene
    EC Number:
    204-872-5
    EC Name:
    Pin-2(10)-ene
    CAS Number:
    127-91-3
    Molecular formula:
    C10H16
    IUPAC Name:
    6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
    Constituent 4
    Chemical structure
    Reference substance name:
    (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    EC Number:
    207-856-6
    EC Name:
    (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    CAS Number:
    498-15-7
    Molecular formula:
    C10H16
    IUPAC Name:
    (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    Constituent 5
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 6
    Chemical structure
    Reference substance name:
    7-methyl-3-methyleneocta-1,6-diene
    EC Number:
    204-622-5
    EC Name:
    7-methyl-3-methyleneocta-1,6-diene
    CAS Number:
    123-35-3
    Molecular formula:
    C10H16
    IUPAC Name:
    7-methyl-3-methyleneocta-1,6-diene
    Constituent 7
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-yl acetate
    EC Number:
    201-265-7
    EC Name:
    p-menth-1-en-8-yl acetate
    CAS Number:
    80-26-2
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl acetate
    Constituent 8
    Chemical structure
    Reference substance name:
    Camphene
    EC Number:
    201-234-8
    EC Name:
    Camphene
    CAS Number:
    79-92-5
    Molecular formula:
    C10H16
    IUPAC Name:
    2,2-diméthyl-3-méthylène-bicyclo[2,2,1]heptane
    Constituent 9
    Chemical structure
    Reference substance name:
    Caryophyllene
    EC Number:
    201-746-1
    EC Name:
    Caryophyllene
    CAS Number:
    87-44-5
    Molecular formula:
    C15H24
    IUPAC Name:
    4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
    Constituent 10
    Chemical structure
    Reference substance name:
    L-born-2-yl acetate
    EC Number:
    227-101-4
    EC Name:
    L-born-2-yl acetate
    CAS Number:
    5655-61-8
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate
    Constituent 11
    Chemical structure
    Reference substance name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    CAS Number:
    529-16-8
    Molecular formula:
    C9 H14
    IUPAC Name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    Constituent 12
    Chemical structure
    Reference substance name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    EC Number:
    208-083-7
    EC Name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    CAS Number:
    508-32-7
    Molecular formula:
    C10H16
    IUPAC Name:
    1,7,7-trimethyltricyclo[2.2.1.0~2,6~]heptane
    Constituent 13
    Chemical structure
    Reference substance name:
    p-mentha-1(7),2-diene
    EC Number:
    209-081-9
    EC Name:
    p-mentha-1(7),2-diene
    CAS Number:
    555-10-2
    Molecular formula:
    C10H16
    IUPAC Name:
    3-methylidene-6-propan-2-ylcyclohexene
    Constituent 14
    Chemical structure
    Reference substance name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    EC Number:
    207-353-1
    EC Name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    CAS Number:
    464-45-9
    Molecular formula:
    C10H18O
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    Constituent 15
    Reference substance name:
    Unknown constituents
    Molecular formula:
    Not applicable (a generic molecular formula cannot be provided for these unknown constituents)
    IUPAC Name:
    Unknown constituents

    Legal Entity Composition(s) open all close all

    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    Humulene
    EC Number:
    229-816-7
    EC Name:
    Humulene
    CAS Number:
    6753-98-6
    Molecular formula:
    C15H24
    IUPAC Name:
    2,6,6,9-tetramethylcycloundeca-1,4,8-triene
    Constituent 2
    Chemical structure
    Reference substance name:
    Dipentene
    EC Number:
    205-341-0
    EC Name:
    Dipentene
    CAS Number:
    138-86-3
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropenyl-1-methylcyclohexene
    Constituent 3
    Chemical structure
    Reference substance name:
    Pin-2(3)-ene
    EC Number:
    201-291-9
    EC Name:
    Pin-2(3)-ene
    CAS Number:
    80-56-8
    Molecular formula:
    C10H16
    IUPAC Name:
    2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
    Constituent 4
    Chemical structure
    Reference substance name:
    Pin-2(10)-ene
    EC Number:
    204-872-5
    EC Name:
    Pin-2(10)-ene
    CAS Number:
    127-91-3
    Molecular formula:
    C10H16
    IUPAC Name:
    6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
    Constituent 5
    Chemical structure
    Reference substance name:
    (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    EC Number:
    207-856-6
    EC Name:
    (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    CAS Number:
    498-15-7
    Molecular formula:
    C10H16
    IUPAC Name:
    (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    Constituent 6
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 7
    Chemical structure
    Reference substance name:
    7-methyl-3-methyleneocta-1,6-diene
    EC Number:
    204-622-5
    EC Name:
    7-methyl-3-methyleneocta-1,6-diene
    CAS Number:
    123-35-3
    Molecular formula:
    C10H16
    IUPAC Name:
    7-methyl-3-methyleneocta-1,6-diene
    Constituent 8
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-yl acetate
    EC Number:
    201-265-7
    EC Name:
    p-menth-1-en-8-yl acetate
    CAS Number:
    80-26-2
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl acetate
    Constituent 9
    Chemical structure
    Reference substance name:
    Camphene
    EC Number:
    201-234-8
    EC Name:
    Camphene
    CAS Number:
    79-92-5
    Molecular formula:
    C10H16
    IUPAC Name:
    2,2-diméthyl-3-méthylène-bicyclo[2,2,1]heptane
    Constituent 10
    Chemical structure
    Reference substance name:
    Caryophyllene
    EC Number:
    201-746-1
    EC Name:
    Caryophyllene
    CAS Number:
    87-44-5
    Molecular formula:
    C15H24
    IUPAC Name:
    4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
    Constituent 11
    Chemical structure
    Reference substance name:
    L-born-2-yl acetate
    EC Number:
    227-101-4
    EC Name:
    L-born-2-yl acetate
    CAS Number:
    5655-61-8
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate
    Constituent 12
    Chemical structure
    Reference substance name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    CAS Number:
    529-16-8
    Molecular formula:
    C9 H14
    IUPAC Name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    Constituent 13
    Chemical structure
    Reference substance name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    EC Number:
    208-083-7
    EC Name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    CAS Number:
    508-32-7
    Molecular formula:
    C10H16
    IUPAC Name:
    1,7,7-trimethyltricyclo[2.2.1.0~2,6~]heptane
    Constituent 14
    Chemical structure
    Reference substance name:
    p-mentha-1(7),2-diene
    EC Number:
    209-081-9
    EC Name:
    p-mentha-1(7),2-diene
    CAS Number:
    555-10-2
    Molecular formula:
    C10H16
    IUPAC Name:
    3-methylidene-6-propan-2-ylcyclohexene
    Constituent 15
    Chemical structure
    Reference substance name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    EC Number:
    207-353-1
    EC Name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    CAS Number:
    464-45-9
    Molecular formula:
    C10H18O
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    Constituent 16
    Reference substance name:
    Unknown constituents
    Molecular formula:
    Not applicable (a generic molecular formula cannot be provided for these unknown constituents)
    IUPAC Name:
    Unknown constituents
    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    Humulene
    EC Number:
    229-816-7
    EC Name:
    Humulene
    CAS Number:
    6753-98-6
    Molecular formula:
    C15H24
    IUPAC Name:
    2,6,6,9-tetramethylcycloundeca-1,4,8-triene
    Constituent 2
    Chemical structure
    Reference substance name:
    Dipentene
    EC Number:
    205-341-0
    EC Name:
    Dipentene
    CAS Number:
    138-86-3
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropenyl-1-methylcyclohexene
    Constituent 3
    Chemical structure
    Reference substance name:
    Pin-2(3)-ene
    EC Number:
    201-291-9
    EC Name:
    Pin-2(3)-ene
    CAS Number:
    80-56-8
    Molecular formula:
    C10H16
    IUPAC Name:
    2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
    Constituent 4
    Chemical structure
    Reference substance name:
    Pin-2(10)-ene
    EC Number:
    204-872-5
    EC Name:
    Pin-2(10)-ene
    CAS Number:
    127-91-3
    Molecular formula:
    C10H16
    IUPAC Name:
    6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
    Constituent 5
    Chemical structure
    Reference substance name:
    (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    EC Number:
    207-856-6
    EC Name:
    (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    CAS Number:
    498-15-7
    Molecular formula:
    C10H16
    IUPAC Name:
    (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    Constituent 6
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 7
    Chemical structure
    Reference substance name:
    7-methyl-3-methyleneocta-1,6-diene
    EC Number:
    204-622-5
    EC Name:
    7-methyl-3-methyleneocta-1,6-diene
    CAS Number:
    123-35-3
    Molecular formula:
    C10H16
    IUPAC Name:
    7-methyl-3-methyleneocta-1,6-diene
    Constituent 8
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-yl acetate
    EC Number:
    201-265-7
    EC Name:
    p-menth-1-en-8-yl acetate
    CAS Number:
    80-26-2
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl acetate
    Constituent 9
    Chemical structure
    Reference substance name:
    Camphene
    EC Number:
    201-234-8
    EC Name:
    Camphene
    CAS Number:
    79-92-5
    Molecular formula:
    C10H16
    IUPAC Name:
    2,2-diméthyl-3-méthylène-bicyclo[2,2,1]heptane
    Constituent 10
    Chemical structure
    Reference substance name:
    Caryophyllene
    EC Number:
    201-746-1
    EC Name:
    Caryophyllene
    CAS Number:
    87-44-5
    Molecular formula:
    C15H24
    IUPAC Name:
    4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
    Constituent 11
    Chemical structure
    Reference substance name:
    L-born-2-yl acetate
    EC Number:
    227-101-4
    EC Name:
    L-born-2-yl acetate
    CAS Number:
    5655-61-8
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate
    Constituent 12
    Chemical structure
    Reference substance name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    CAS Number:
    529-16-8
    Molecular formula:
    C9 H14
    IUPAC Name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    Constituent 13
    Chemical structure
    Reference substance name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    EC Number:
    208-083-7
    EC Name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    CAS Number:
    508-32-7
    Molecular formula:
    C10H16
    IUPAC Name:
    1,7,7-trimethyltricyclo[2.2.1.0~2,6~]heptane
    Constituent 14
    Chemical structure
    Reference substance name:
    p-mentha-1(7),2-diene
    EC Number:
    209-081-9
    EC Name:
    p-mentha-1(7),2-diene
    CAS Number:
    555-10-2
    Molecular formula:
    C10H16
    IUPAC Name:
    3-methylidene-6-propan-2-ylcyclohexene
    Constituent 15
    Chemical structure
    Reference substance name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    EC Number:
    207-353-1
    EC Name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    CAS Number:
    464-45-9
    Molecular formula:
    C10H18O
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    Constituent 16
    Reference substance name:
    Unknown constituents
    Molecular formula:
    Not applicable (a generic molecular formula cannot be provided for these unknown constituents)
    IUPAC Name:
    Unknown constituents
    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    Dipentene
    EC Number:
    205-341-0
    EC Name:
    Dipentene
    CAS Number:
    138-86-3
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropenyl-1-methylcyclohexene
    Constituent 2
    Chemical structure
    Reference substance name:
    Pin-2(3)-ene
    EC Number:
    201-291-9
    EC Name:
    Pin-2(3)-ene
    CAS Number:
    80-56-8
    Molecular formula:
    C10H16
    IUPAC Name:
    2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
    Constituent 3
    Chemical structure
    Reference substance name:
    Pin-2(10)-ene
    EC Number:
    204-872-5
    EC Name:
    Pin-2(10)-ene
    CAS Number:
    127-91-3
    Molecular formula:
    C10H16
    IUPAC Name:
    6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
    Constituent 4
    Chemical structure
    Reference substance name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    EC Number:
    236-719-3
    EC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    CAS Number:
    13466-78-9
    Molecular formula:
    C10H16
    IUPAC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    Constituent 5
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 6
    Chemical structure
    Reference substance name:
    7-methyl-3-methyleneocta-1,6-diene
    EC Number:
    204-622-5
    EC Name:
    7-methyl-3-methyleneocta-1,6-diene
    CAS Number:
    123-35-3
    Molecular formula:
    C10H16
    IUPAC Name:
    7-methyl-3-methyleneocta-1,6-diene
    Constituent 7
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-yl acetate
    EC Number:
    201-265-7
    EC Name:
    p-menth-1-en-8-yl acetate
    CAS Number:
    80-26-2
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl acetate
    Constituent 8
    Chemical structure
    Reference substance name:
    Camphene
    EC Number:
    201-234-8
    EC Name:
    Camphene
    CAS Number:
    79-92-5
    Molecular formula:
    C10H16
    IUPAC Name:
    2,2-diméthyl-3-méthylène-bicyclo[2,2,1]heptane
    Constituent 9
    Chemical structure
    Reference substance name:
    Caryophyllene
    EC Number:
    201-746-1
    EC Name:
    Caryophyllene
    CAS Number:
    87-44-5
    Molecular formula:
    C15H24
    IUPAC Name:
    4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
    Constituent 10
    Chemical structure
    Reference substance name:
    L-born-2-yl acetate
    EC Number:
    227-101-4
    EC Name:
    L-born-2-yl acetate
    CAS Number:
    5655-61-8
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate
    Constituent 11
    Chemical structure
    Reference substance name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    CAS Number:
    529-16-8
    Molecular formula:
    C9 H14
    IUPAC Name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    Constituent 12
    Chemical structure
    Reference substance name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    EC Number:
    208-083-7
    EC Name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    CAS Number:
    508-32-7
    Molecular formula:
    C10H16
    IUPAC Name:
    1,7,7-trimethyltricyclo[2.2.1.0~2,6~]heptane
    Constituent 13
    Chemical structure
    Reference substance name:
    p-mentha-1(7),2-diene
    EC Number:
    209-081-9
    EC Name:
    p-mentha-1(7),2-diene
    CAS Number:
    555-10-2
    Molecular formula:
    C10H16
    IUPAC Name:
    3-methylidene-6-propan-2-ylcyclohexene
    Constituent 14
    Chemical structure
    Reference substance name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    EC Number:
    207-353-1
    EC Name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    CAS Number:
    464-45-9
    Molecular formula:
    C10H18O
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    Constituent 15
    Reference substance name:
    Unknown constituents
    Molecular formula:
    Not applicable (a generic molecular formula cannot be provided for these unknown constituents)
    IUPAC Name:
    Unknown constituents
    State Form:
    liquid


    Constituent 1
    Reference substance name:
    Unknown constituents
    Molecular formula:
    Not applicable (a generic molecular formula cannot be provided for these unknown constituents)
    IUPAC Name:
    Unknown constituents
    Constituent 2
    Chemical structure
    Reference substance name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    EC Number:
    207-353-1
    EC Name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    CAS Number:
    464-45-9
    Molecular formula:
    C10H18O
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    Constituent 3
    Chemical structure
    Reference substance name:
    p-mentha-1(7),2-diene
    EC Number:
    209-081-9
    EC Name:
    p-mentha-1(7),2-diene
    CAS Number:
    555-10-2
    Molecular formula:
    C10H16
    IUPAC Name:
    3-methylidene-6-propan-2-ylcyclohexene
    Constituent 4
    Chemical structure
    Reference substance name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    EC Number:
    208-083-7
    EC Name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    CAS Number:
    508-32-7
    Molecular formula:
    C10H16
    IUPAC Name:
    1,7,7-trimethyltricyclo[2.2.1.0~2,6~]heptane
    Constituent 5
    Chemical structure
    Reference substance name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    CAS Number:
    529-16-8
    Molecular formula:
    C9 H14
    IUPAC Name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    Constituent 6
    Chemical structure
    Reference substance name:
    L-born-2-yl acetate
    EC Number:
    227-101-4
    EC Name:
    L-born-2-yl acetate
    CAS Number:
    5655-61-8
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate
    Constituent 7
    Chemical structure
    Reference substance name:
    Caryophyllene
    EC Number:
    201-746-1
    EC Name:
    Caryophyllene
    CAS Number:
    87-44-5
    Molecular formula:
    C15H24
    IUPAC Name:
    4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
    Constituent 8
    Chemical structure
    Reference substance name:
    Camphene
    EC Number:
    201-234-8
    EC Name:
    Camphene
    CAS Number:
    79-92-5
    Molecular formula:
    C10H16
    IUPAC Name:
    2,2-diméthyl-3-méthylène-bicyclo[2,2,1]heptane
    Constituent 9
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-yl acetate
    EC Number:
    201-265-7
    EC Name:
    p-menth-1-en-8-yl acetate
    CAS Number:
    80-26-2
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl acetate
    Constituent 10
    Chemical structure
    Reference substance name:
    7-methyl-3-methyleneocta-1,6-diene
    EC Number:
    204-622-5
    EC Name:
    7-methyl-3-methyleneocta-1,6-diene
    CAS Number:
    123-35-3
    Molecular formula:
    C10H16
    IUPAC Name:
    7-methyl-3-methyleneocta-1,6-diene
    Constituent 11
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 12
    Chemical structure
    Reference substance name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    EC Number:
    236-719-3
    EC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    CAS Number:
    13466-78-9
    Molecular formula:
    C10H16
    IUPAC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    Constituent 13
    Chemical structure
    Reference substance name:
    Pin-2(10)-ene
    EC Number:
    204-872-5
    EC Name:
    Pin-2(10)-ene
    CAS Number:
    127-91-3
    Molecular formula:
    C10H16
    IUPAC Name:
    6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
    Constituent 14
    Chemical structure
    Reference substance name:
    Pin-2(3)-ene
    EC Number:
    201-291-9
    EC Name:
    Pin-2(3)-ene
    CAS Number:
    80-56-8
    Molecular formula:
    C10H16
    IUPAC Name:
    2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
    Constituent 15
    Chemical structure
    Reference substance name:
    Dipentene
    EC Number:
    205-341-0
    EC Name:
    Dipentene
    CAS Number:
    138-86-3
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropenyl-1-methylcyclohexene
    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    Pin-2(3)-ene
    EC Number:
    201-291-9
    EC Name:
    Pin-2(3)-ene
    CAS Number:
    80-56-8
    Molecular formula:
    C10H16
    IUPAC Name:
    2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
    Constituent 2
    Chemical structure
    Reference substance name:
    Camphene
    EC Number:
    201-234-8
    EC Name:
    Camphene
    CAS Number:
    79-92-5
    Molecular formula:
    C10H16
    IUPAC Name:
    2,2-diméthyl-3-méthylène-bicyclo[2,2,1]heptane
    Constituent 3
    Chemical structure
    Reference substance name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    EC Number:
    236-719-3
    EC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    CAS Number:
    13466-78-9
    Molecular formula:
    C10H16
    IUPAC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    Constituent 4
    Chemical structure
    Reference substance name:
    L-born-2-yl acetate
    EC Number:
    227-101-4
    EC Name:
    L-born-2-yl acetate
    CAS Number:
    5655-61-8
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate
    Constituent 5
    Chemical structure
    Reference substance name:
    Dipentene
    EC Number:
    205-341-0
    EC Name:
    Dipentene
    CAS Number:
    138-86-3
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropenyl-1-methylcyclohexene
    Constituent 6
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 7
    Chemical structure
    Reference substance name:
    7-methyl-3-methyleneocta-1,6-diene
    EC Number:
    204-622-5
    EC Name:
    7-methyl-3-methyleneocta-1,6-diene
    CAS Number:
    123-35-3
    Molecular formula:
    C10H16
    IUPAC Name:
    7-methyl-3-methyleneocta-1,6-diene
    Constituent 8
    Chemical structure
    Reference substance name:
    Pin-2(10)-ene
    EC Number:
    204-872-5
    EC Name:
    Pin-2(10)-ene
    CAS Number:
    127-91-3
    Molecular formula:
    C10H16
    IUPAC Name:
    6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
    Constituent 9
    Chemical structure
    Reference substance name:
    Caryophyllene
    EC Number:
    201-746-1
    EC Name:
    Caryophyllene
    CAS Number:
    87-44-5
    Molecular formula:
    C15H24
    IUPAC Name:
    4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
    Constituent 10
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-yl acetate
    EC Number:
    201-265-7
    EC Name:
    p-menth-1-en-8-yl acetate
    CAS Number:
    80-26-2
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl acetate
    Constituent 11
    Chemical structure
    Reference substance name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    CAS Number:
    529-16-8
    Molecular formula:
    C9H14
    IUPAC Name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    Constituent 12
    Chemical structure
    Reference substance name:
    p-mentha-1(7),2-diene
    EC Number:
    209-081-9
    EC Name:
    p-mentha-1(7),2-diene
    CAS Number:
    555-10-2
    Molecular formula:
    C10H16
    IUPAC Name:
    3-methylidene-6-propan-2-ylcyclohexene
    Constituent 13
    Chemical structure
    Reference substance name:
    DL-borneol
    EC Number:
    208-080-0
    EC Name:
    DL-borneol
    CAS Number:
    507-70-0
    Molecular formula:
    C10H18O
    IUPAC Name:
    4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol
    Constituent 14
    Chemical structure
    Reference substance name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    EC Number:
    208-083-7
    EC Name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    CAS Number:
    508-32-7
    Molecular formula:
    C10H16
    IUPAC Name:
    1,7,7-trimethyltricyclo[2.2.1.0~2,6~]heptane
    Constituent 15
    Chemical structure
    Reference substance name:
    4,7,7-trimethylbicyclo[4.1.0]hept-4-ene
    CAS Number:
    4497-92-1
    Molecular formula:
    C10H16
    IUPAC Name:
    4,7,7-trimethylbicyclo[4.1.0]hept-4-ene
    Constituent 16
    Chemical structure
    Reference substance name:
    Humulene
    EC Number:
    229-816-7
    EC Name:
    Humulene
    CAS Number:
    6753-98-6
    Molecular formula:
    C15H24
    IUPAC Name:
    2,6,6,9-tetramethylcycloundeca-1,4,8-triene
    Constituent 17
    Reference substance name:
    not applicable
    Molecular formula:
    not applicable
    IUPAC Name:
    not applicable
    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    Dipentene
    EC Number:
    205-341-0
    EC Name:
    Dipentene
    CAS Number:
    138-86-3
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropenyl-1-methylcyclohexene
    Constituent 2
    Chemical structure
    Reference substance name:
    Pin-2(3)-ene
    EC Number:
    201-291-9
    EC Name:
    Pin-2(3)-ene
    CAS Number:
    80-56-8
    Molecular formula:
    C10H16
    IUPAC Name:
    2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
    Constituent 3
    Chemical structure
    Reference substance name:
    Pin-2(10)-ene
    EC Number:
    204-872-5
    EC Name:
    Pin-2(10)-ene
    CAS Number:
    127-91-3
    Molecular formula:
    C10H16
    IUPAC Name:
    6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
    Constituent 4
    Chemical structure
    Reference substance name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    EC Number:
    236-719-3
    EC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    CAS Number:
    13466-78-9
    Molecular formula:
    C10H16
    IUPAC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    Constituent 5
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 6
    Chemical structure
    Reference substance name:
    7-methyl-3-methyleneocta-1,6-diene
    EC Number:
    204-622-5
    EC Name:
    7-methyl-3-methyleneocta-1,6-diene
    CAS Number:
    123-35-3
    Molecular formula:
    C10H16
    IUPAC Name:
    7-methyl-3-methyleneocta-1,6-diene
    Constituent 7
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-yl acetate
    EC Number:
    201-265-7
    EC Name:
    p-menth-1-en-8-yl acetate
    CAS Number:
    80-26-2
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl acetate
    Constituent 8
    Chemical structure
    Reference substance name:
    Camphene
    EC Number:
    201-234-8
    EC Name:
    Camphene
    CAS Number:
    79-92-5
    Molecular formula:
    C10H16
    IUPAC Name:
    2,2-diméthyl-3-méthylène-bicyclo[2,2,1]heptane
    Constituent 9
    Chemical structure
    Reference substance name:
    Caryophyllene
    EC Number:
    201-746-1
    EC Name:
    Caryophyllene
    CAS Number:
    87-44-5
    Molecular formula:
    C15H24
    IUPAC Name:
    4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
    Constituent 10
    Chemical structure
    Reference substance name:
    L-born-2-yl acetate
    EC Number:
    227-101-4
    EC Name:
    L-born-2-yl acetate
    CAS Number:
    5655-61-8
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate
    Constituent 11
    Chemical structure
    Reference substance name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    CAS Number:
    529-16-8
    Molecular formula:
    C9 H14
    IUPAC Name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    Constituent 12
    Chemical structure
    Reference substance name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    EC Number:
    208-083-7
    EC Name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    CAS Number:
    508-32-7
    Molecular formula:
    C10H16
    IUPAC Name:
    1,7,7-trimethyltricyclo[2.2.1.0~2,6~]heptane
    Constituent 13
    Chemical structure
    Reference substance name:
    p-mentha-1(7),2-diene
    EC Number:
    209-081-9
    EC Name:
    p-mentha-1(7),2-diene
    CAS Number:
    555-10-2
    Molecular formula:
    C10H16
    IUPAC Name:
    3-methylidene-6-propan-2-ylcyclohexene
    Constituent 14
    Chemical structure
    Reference substance name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    EC Number:
    207-353-1
    EC Name:
    (1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    CAS Number:
    464-45-9
    Molecular formula:
    C10H18O
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    Dipentene
    EC Number:
    205-341-0
    EC Name:
    Dipentene
    CAS Number:
    138-86-3
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropenyl-1-methylcyclohexene
    Constituent 2
    Chemical structure
    Reference substance name:
    Pin-2(3)-ene
    EC Number:
    201-291-9
    EC Name:
    Pin-2(3)-ene
    CAS Number:
    80-56-8
    Molecular formula:
    C10H16
    IUPAC Name:
    2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
    Constituent 3
    Chemical structure
    Reference substance name:
    Pin-2(10)-ene
    EC Number:
    204-872-5
    EC Name:
    Pin-2(10)-ene
    CAS Number:
    127-91-3
    Molecular formula:
    C10H16
    IUPAC Name:
    6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
    Constituent 4
    Chemical structure
    Reference substance name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    EC Number:
    236-719-3
    EC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    CAS Number:
    13466-78-9
    Molecular formula:
    C10H16
    IUPAC Name:
    3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
    Constituent 5
    Chemical structure
    Reference substance name:
    7-methyl-3-methyleneocta-1,6-diene
    EC Number:
    204-622-5
    EC Name:
    7-methyl-3-methyleneocta-1,6-diene
    CAS Number:
    123-35-3
    Molecular formula:
    C10H16
    IUPAC Name:
    7-methyl-3-methyleneocta-1,6-diene
    Constituent 6
    Chemical structure
    Reference substance name:
    Camphene
    EC Number:
    201-234-8
    EC Name:
    Camphene
    CAS Number:
    79-92-5
    Molecular formula:
    C10H16
    IUPAC Name:
    2,2-diméthyl-3-méthylène-bicyclo[2,2,1]heptane
    Constituent 7
    Chemical structure
    Reference substance name:
    Caryophyllene
    EC Number:
    201-746-1
    EC Name:
    Caryophyllene
    CAS Number:
    87-44-5
    Molecular formula:
    C15H24
    IUPAC Name:
    4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
    Constituent 8
    Chemical structure
    Reference substance name:
    L-born-2-yl acetate
    EC Number:
    227-101-4
    EC Name:
    L-born-2-yl acetate
    CAS Number:
    5655-61-8
    Molecular formula:
    C12H20O2
    IUPAC Name:
    1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate
    Constituent 9
    Chemical structure
    Reference substance name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    CAS Number:
    529-16-8
    Molecular formula:
    C9 H14
    IUPAC Name:
    2,3-dimethylbicyclo[2.2.1]hept-2-ene
    Constituent 10
    Chemical structure
    Reference substance name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    EC Number:
    208-083-7
    EC Name:
    1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
    CAS Number:
    508-32-7
    Molecular formula:
    C10H16
    IUPAC Name:
    1,7,7-trimethyltricyclo[2.2.1.0~2,6~]heptane
    Constituent 11
    Chemical structure
    Reference substance name:
    p-mentha-1(7),2-diene
    EC Number:
    209-081-9
    EC Name:
    p-mentha-1(7),2-diene
    CAS Number:
    555-10-2
    Molecular formula:
    C10H16
    IUPAC Name:
    3-methylidene-6-propan-2-ylcyclohexene
    Constituent 12
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-ol
    EC Number:
    202-680-6
    EC Name:
    p-menth-1-en-8-ol
    CAS Number:
    98-55-5
    Molecular formula:
    C10H18O
    IUPAC Name:
    alpha,alpha-4-trimethyl-3-cyclohexene-1-methanol
    Constituent 13
    Chemical structure
    Reference substance name:
    Humulene
    EC Number:
    229-816-7
    EC Name:
    Humulene
    CAS Number:
    6753-98-6
    Molecular formula:
    C15H24
    IUPAC Name:
    2,6,6,9-tetramethylcycloundeca-1,4,8-triene
    Constituent 14
    Chemical structure
    Reference substance name:
    DL-borneol
    EC Number:
    208-080-0
    EC Name:
    DL-borneol
    CAS Number:
    507-70-0
    Molecular formula:
    C10H18O
    IUPAC Name:
    4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol
    Constituent 15
    Reference substance name:
    Unknown constituents
    Molecular formula:
    Not applicable (a generic molecular formula cannot be provided for these unknown constituents)
    IUPAC Name:
    Unknown constituents

    Composition(s) generated upon use

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