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Reference substances

Currently viewing:
IUPAC name:
3a,4,5,6,7,7a-hexahydro-1H-4,7-methanoinden-5-yl acetate

Inventory

EC number:
219-700-4
EC name:
Tricyclo[5.2.1.02,6]dec-4-en-8-yl acetate
CAS number:
2500-83-6
CAS number:
2500-83-6
Synonyms
Names:
4,7-Methano-1H-inden-5-ol, 3a,4,5,6,7,7a-hexahydro-, acetate
Identifier:
IUPAC name
3a, 4, 5, 6, 7a hexahydro-4, 7-methano-1H-inden-5-yl acetate
Identifier:
other: InChl
1S/C12H16O2/c1-7(13)14-12-6-8-5-11(12)10-4-2-3-9(8)10/h2,4,8-12H,3,5-6H2,1H3
Identifier:
other: SMILES notation
C1[C@@H]2C[C@@H]([C@@H]1[C@@H]1[C@@H]2CC=C1)OC(=O)C
Identifier:
other: SMILES notation
CC(=O)OC1CC2CC1C3C2CC=C3.

Molecular and structural information

Molecular formula:
C12H16O2
Molecular weight:
192.254
SMILES notation:
CC(=O)OC1CC2CC1C3C=CCC23
InChl:
InChI=1/C12H16O2/c1-7(13)14-12-6-8-5-11(12)10-4-2-3-9(8)10/h2,4,8-12H,3,5-6H2,1H3
Structural formula:
Chemical structure

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