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(3R,1S)-(-)-3-(5-Isopropylidene-1-methyl-2-oxocyclohexyl)butyric acid
SpectraBase Compound ID EK8FCnTvfOi
InChI InChI=1S/C14H22O3/c1-9(2)11-5-6-12(15)14(4,8-11)10(3)7-13(16)17/h10H,5-8H2,1-4H3,(H,16,17)/t10-,14+/m1/s1
InChIKey CKWRGZMSONJDBI-YGRLFVJLSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FqoncPIum
Name (3R,1S)-(-)-3-(5-Isopropylidene-1-methyl-2-oxocyclohexyl)butyric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-9(2)11-5-6-12(15)14(4,8-11)10(3)7-13(16)17/h10H,5-8H2,1-4H3,(H,16,17)/t10-,14+/m1/s1
InChIKey CKWRGZMSONJDBI-YGRLFVJLSA-N
Molecular Weight 238.327 g/mol
SMILES OC(C[C@]([C@@]1(CC(=C(C)C)CCC1=O)C)(C)[H])=O
SPLASH splash10-0a4u-8920000000-cbfd72a2778bdbd76b5e
Source of Spectrum QC-11-4980-9
Synonyms (3R)-3-[(1S)-1-methyl-5-(1-methylethylidene)-2-oxocyclohexyl]butanoic acid
Wiley ID 860261