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Reference substances

Reference substances

IUPAC name:
(2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid

Inventory

CAS number:
80875-98-5
Synonyms
Names:
L-Octahydroindole-2-carboxylic acid
Identifier:
EC number
617-180-7
Identifier:
common name
9490 PERHYDROACIDE S
Identifier:
other: Molecular formula
C9H15NO2
Identifier:
other: SMILES notation
O=C([C@H]1N[C@@]2([H])CCCC[C@@]2([H])C1O
(2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid

Molecular and structural information

Molecular formula:
C9 H15 N O2
Molecular weight:
ca. 169.22
SMILES notation:
C1CCC2C(C1)CC(N2)C(=O)O

Isomeric :
C1CC[C@H]2[C@@H](C1)C[C@H](N2)C(=O)O
InChl:
CQYBNXGHMBNGCG-FXQIFTODSA-N
Structural formula:
Chemical structure

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