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2-Cyclohexene-1-carboxylic acid, 1-ethyl-6-oxo-, methyl ester
SpectraBase Compound ID LsHHqxRNtSU
InChI InChI=1S/C10H14O3/c1-3-10(9(12)13-2)7-5-4-6-8(10)11/h5,7H,3-4,6H2,1-2H3
InChIKey JZKQBWFNOMKIGE-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 9QMEd8E88gB
Name 2-Cyclohexene-1-carboxylic acid, 1-ethyl-6-oxo-, methyl ester
Alternate Name(s) 2-Carbomethoxy-2-ethyl-3-cyclohexen-1-one Methyl 1-ethyl-6-oxo-2-cyclohexene-1-carboxylate
CAS Registry Number 86990-78-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-3-10(9(12)13-2)7-5-4-6-8(10)11/h5,7H,3-4,6H2,1-2H3
InChIKey JZKQBWFNOMKIGE-UHFFFAOYSA-N
Molecular Weight 182.219 g/mol
SMILES C1(C(=O)OC)(C(=O)CCC=C1)CC
SPLASH splash10-000x-0900000000-499c2e12b6b032a71d31
Source of Spectrum J-49-4436-0
Wiley ID 1178396