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3-Cyclohexene-1-carboxylic acid, 4-methoxy-6-methyl-2-oxo-, methyl ester
SpectraBase Compound ID FrSoOrJVYcI
InChI InChI=1S/C10H14O4/c1-6-4-7(13-2)5-8(11)9(6)10(12)14-3/h5-6,9H,4H2,1-3H3
InChIKey BIBYTJJVVBGZMA-UHFFFAOYSA-N
Mol Weight 198.22 g/mol
Molecular Formula C10H14O4
Exact Mass 198.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57HbHF4FV0d
Name 3-Cyclohexene-1-carboxylic acid, 4-methoxy-6-methyl-2-oxo-, methyl ester
Alternate Name(s) Methyl 4-methoxy-6-methyl-2-oxo-3-cyclohexene-1-carboxylate 2-keto-4-methoxy-6-methyl-cyclohex-3-ene-1-carboxylic acid methyl ester 4-Methoxy-6-methyl-2-oxo-1-cyclohex-3-enecarboxylic acid methyl ester Methyl 4-methoxy-6-methyl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Methyl 4-methoxy-6-methyl-2-oxo-3-cyclohexenecarboxylate Methyl 4-methoxy-6-methyl-2-oxo-cyclohex-3-ene-1-carboxylate
CAS Registry Number 52452-25-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O4
InChI InChI=1S/C10H14O4/c1-6-4-7(13-2)5-8(11)9(6)10(12)14-3/h5-6,9H,4H2,1-3H3
InChIKey BIBYTJJVVBGZMA-UHFFFAOYSA-N
Molecular Weight 198.218 g/mol
SMILES C1(OC)=CC(C(C(C1)C)C(=O)OC)=O
SPLASH splash10-014s-9500000000-4d9e227d33b1b854bf96
Wiley ID 1481616