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1H-Indene-4-carboxylic acid, octahydro-7a-methyl-1-oxo-, (3a.alpha.,4.alpha.,7a.beta.)-
SpectraBase Compound ID 9gQcxE9c9SK
InChI InChI=1S/C11H16O3/c1-11-6-2-3-7(10(13)14)8(11)4-5-9(11)12/h7-8H,2-6H2,1H3,(H,13,14)
InChIKey UCIBBKQAXHSVQB-UHFFFAOYSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8XHxYxQyJFS
Name 1H-Indene-4-carboxylic acid, octahydro-7a-methyl-1-oxo-, (3a.alpha.,4.alpha.,7a.beta.)-
CAS Registry Number 13367-96-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-11-6-2-3-7(10(13)14)8(11)4-5-9(11)12/h7-8H,2-6H2,1H3,(H,13,14)
InChIKey UCIBBKQAXHSVQB-UHFFFAOYSA-N
Molecular Weight 196.246 g/mol
SMILES OC(C1C2C(C)(C(=O)CC2)CCC1)=O
SPLASH splash10-0pi0-0900000000-ba0624a3bc54f151962a
Source of Spectrum T-67-2174-0
Synonyms 4-Indancarboxylic acid, hexahydro-7a-methyl-1-oxo-, trans- 7a-Methyl-1-oxooctahydro-1H-indene-4-carboxylic acid 1-keto-7a-methyl-3,3a,4,5,6,7-hexahydro-2H-indene-4-carboxylic acid 7a-methyl-1-oxidanylidene-3,3a,4,5,6,7-hexahydro-2H-indene-4-carboxylic acid 7a-methyl-1-oxo-3,3a,4,5,6,7-hexahydro-2H-indene-4-carboxylic acid
Wiley ID 1193112