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Reference substances

Reference substances

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General information

Inventory

EC number:
445-790-1
EC name:
-
CAS number:
-
Description:
GASKAMINE 240

No inventory information available

Reference substance information

Synonyms
Names:
G-240
MXDA/SM ADDUCT
1,3-Benzenedimethanamine, N-(2-phenylethyl) derivs.

CAS information

CAS number:
404362-22-7

Molecular and structural information

Molecular formula:
Component 1: C16H20N2
Components 2 and 3: C24H28N2
Molecular weight:
>= 240.34 - <= 344.49
SMILES notation:
Component 1
Linear isomer: NCC1=CC(CNCCC2=CC=CC=C2)=CC=C1
Branced isomer: CC(NCC1=CC=CC(CN)=C1)C1=CC=CC=C1
Component 2
Double linear isomer: C(CC1=CC=CC=C1)NCC1=CC(CNCCC2=CC=CC=C2)=CC=C1
Linar & branched isomer: CC(NCC1=CC=CC(CNCCC2=CC=CC=C2)=C1)C1=CC=CC=C1
Double branched isomer: CC(NCC1=CC(CNC(C)C2=CC=CC=C2)=CC=C1)C1=CC=CC=C1
Component 3
NCC1=CC=CC(CN(CCC2=CC=CC=C2)CCC2=CC=CC=C2)=C1
Structural formula:
Chemical structure