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Cyclohexanecarboxylic acid, 3-methylene-2-oxo-, methyl ester
SpectraBase Compound ID AGlX6uux6j3
InChI InChI=1S/C9H12O3/c1-6-4-3-5-7(8(6)10)9(11)12-2/h7H,1,3-5H2,2H3
InChIKey MXMFGOUKCQJUHD-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UQRLoiRmuB
Name Cyclohexanecarboxylic acid, 3-methylene-2-oxo-, methyl ester
Alternate Name(s) Methyl 3-methylene-2-oxocyclohexanecarboxylate 2-keto-3-methylene-cyclohexanecarboxylic acid methyl ester 3-Methylene-2-oxo-1-cyclohexanecarboxylic acid methyl ester Methyl 3-methylidene-2-oxidanylidene-cyclohexane-1-carboxylate Methyl 3-methylidene-2-oxocyclohexane-1-carboxylate
CAS Registry Number 55956-42-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-6-4-3-5-7(8(6)10)9(11)12-2/h7H,1,3-5H2,2H3
InChIKey MXMFGOUKCQJUHD-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES C(OC)(=O)C1C(=O)C(=C)CCC1
SPLASH splash10-0fbi-9200000000-3b9bbb62965158055502
Source of Spectrum EP-2752-0-0
Wiley ID 1164317