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1-But-3-enyl-2-keto-cyclohexanecarboxylic acid ethyl ester
SpectraBase Compound ID KZOwoDdFUw0
InChI InChI=1S/C13H20O3/c1-3-5-9-13(12(15)16-4-2)10-7-6-8-11(13)14/h3H,1,4-10H2,2H3
InChIKey SKCUOERRKMBLSC-UHFFFAOYSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9PHW66c1dRg
Name 1-But-3-enyl-2-keto-cyclohexanecarboxylic acid ethyl ester
Alternate Name(s) 1-But-3-enyl-2-oxo-1-cyclohexanecarboxylic acid ethyl ester Ethyl 1-but-3-enyl-2-oxidanylidene-cyclohexane-1-carboxylate Ethyl 1-but-3-enyl-2-oxo-cyclohexanecarboxylate Ethyl 1-but-3-enyl-2-oxocyclohexane-1-carboxylate
CAS Registry Number 61771-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-3-5-9-13(12(15)16-4-2)10-7-6-8-11(13)14/h3H,1,4-10H2,2H3
InChIKey SKCUOERRKMBLSC-UHFFFAOYSA-N
Molecular Weight 224.300 g/mol
SMILES C1(C(=O)OCC)(C(=O)CCCC1)CCC=C
SPLASH splash10-00di-3900000000-bc9ddf9f922e279ae909
Source of Spectrum J-51-4199-11
Wiley ID 1225310