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2-Methyl-3-oxobutanoic acid 1-cyclohexenylmethyl ester

View entire compound with spectra: 1 MS (GC)

2-Methyl-3-oxobutanoic acid 1-cyclohexenylmethyl ester
SpectraBase Compound ID 8YQT6weoFaW
InChI InChI=1S/C12H18O3/c1-9(10(2)13)12(14)15-8-11-6-4-3-5-7-11/h6,9H,3-5,7-8H2,1-2H3
InChIKey GVUMEHKNMSKNRS-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5F2sAAXkx8
Name 2-Methyl-3-oxobutanoic acid 1-cyclohexenylmethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-9(10(2)13)12(14)15-8-11-6-4-3-5-7-11/h6,9H,3-5,7-8H2,1-2H3
InChIKey GVUMEHKNMSKNRS-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES C(C(OCC1=CCCCC1)=O)(C(=O)C)C
SPLASH splash10-0006-9000000000-a922171c542e6b16f0c6
Source of Spectrum U-1996-1103-1
Synonyms 3-keto-2-methyl-butyric acid cyclohexen-1-ylmethyl ester cyclohexen-1-ylmethyl 2-methyl-3-oxidanylidene-butanoate cyclohexen-1-ylmethyl 2-methyl-3-oxo-butanoate
Wiley ID 768523