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7-Benzocyclodecenecarboxylic acid, 5,6,7,8,9,10,11,12-octahydro-11-methyl-12-oxo-, methyl ester
SpectraBase Compound ID E3REDfhBM5S
InChI InChI=1S/C17H22O3/c1-12-6-5-8-14(17(19)20-2)11-10-13-7-3-4-9-15(13)16(12)18/h3-4,7,9,12,14H,5-6,8,10-11H2,1-2H3
InChIKey GNKPFFKKYQPZFK-UHFFFAOYSA-N
Mol Weight 274.36 g/mol
Molecular Formula C17H22O3
Exact Mass 274.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFppMwEoaZd
Name 7-Benzocyclodecenecarboxylic acid, 5,6,7,8,9,10,11,12-octahydro-11-methyl-12-oxo-, methyl ester
CAS Registry Number 96834-60-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O3
InChI InChI=1S/C17H22O3/c1-12-6-5-8-14(17(19)20-2)11-10-13-7-3-4-9-15(13)16(12)18/h3-4,7,9,12,14H,5-6,8,10-11H2,1-2H3
InChIKey GNKPFFKKYQPZFK-UHFFFAOYSA-N
Molecular Weight 274.360 g/mol
SMILES C1(c2c(CCC(C(=O)OC)CCCC1C)cccc2)=O
SPLASH splash10-0006-2910000000-d9c64ff225337c39c3cc
Source of Spectrum KC-1985-511-19
Synonyms 10-Methoxycarbonyl-6-methyl-7,8,9,10,11,12-hexahydrobenzo-cyclodecen-5(6H)-one Methyl 11-methyl-12-oxo-5,6,7,8,9,10,11,12-octahydrobenzo[a]cyclodecene-7-carboxylate
Wiley ID 1278430