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Methyl (2,4,6-trimethyl-5-oxo-3-cyclohexen-1-yl)acetate
SpectraBase Compound ID IYmnk7fvJSs
InChI InChI=1S/C12H18O3/c1-7-5-8(2)12(14)9(3)10(7)6-11(13)15-4/h5,7,9-10H,6H2,1-4H3
InChIKey VJTNAHSTZPPXCN-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 1djWCq9PWEg
Name Methyl (2,4,6-trimethyl-5-oxo-3-cyclohexen-1-yl)acetate
CAS Registry Number 33631-36-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-7-5-8(2)12(14)9(3)10(7)6-11(13)15-4/h5,7,9-10H,6H2,1-4H3
InChIKey VJTNAHSTZPPXCN-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES CC1C(=O)C(C)=CC(C)C1CC(=O)OC
SPLASH splash10-000i-1900000000-b5a772c3f9b1ced0b29e
Source of Spectrum J-51-4269-11
Synonyms 2-(2,4,6-trimethyl-5-oxo-1-cyclohex-3-enyl)acetic acid methyl ester 2-(5-keto-2,4,6-trimethyl-cyclohex-3-en-1-yl)acetic acid methyl ester Methyl 2-(2,4,6-trimethyl-5-oxidanylidene-cyclohex-3-en-1-yl)ethanoate Methyl 2-(2,4,6-trimethyl-5-oxo-cyclohex-3-en-1-yl)acetate
Wiley ID 1209147