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1-METHYL-4-OXO-2-CYCLOHEXEN-1-CARBONSAEURE-ETHYLESTER
SpectraBase Compound ID 1fBBS3so3oy
InChI InChI=1S/C10H14O3/c1-3-13-9(12)10(2)6-4-8(11)5-7-10/h4,6H,3,5,7H2,1-2H3
InChIKey CKDSTNLSYQLPRF-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AryBW0YgEl0
Name 2-Cyclohexene-1-carboxylic acid, 1-methyl-4-oxo-, ethyl ester
Alternate Name(s) Ethyl 1-methyl-4-oxo-2-cyclohexene-1-carboxylate 1-Methyl-4-oxo-1-cyclohex-2-enecarboxylic acid ethyl ester 4-keto-1-methyl-cyclohex-2-ene-1-carboxylic acid ethyl ester Ethyl 1-methyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Ethyl 1-methyl-4-oxo-cyclohex-2-ene-1-carboxylate
CAS Registry Number 1489-55-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-3-13-9(12)10(2)6-4-8(11)5-7-10/h4,6H,3,5,7H2,1-2H3
InChIKey CKDSTNLSYQLPRF-UHFFFAOYSA-N
Molecular Weight 182.219 g/mol
SMILES C1(=O)CCC(C=C1)(C(=O)OCC)C
SPLASH splash10-0kea-9300000000-d952c6bc1f99bea1029f
Wiley ID 1488287