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2,4-DIMETHYL-3-FORMYL-4-ETHOXYCARBONYLCYCLOHEX-2-ENE-1-ONE
SpectraBase Compound ID Jew3RP74a45
InChI InChI=1S/C12H16O4/c1-4-16-11(15)12(3)6-5-10(14)8(2)9(12)7-13/h7H,4-6H2,1-3H3
InChIKey GUHIQHVBTAFKQG-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BFa274UdmGs
Name 2-formyl-1,3-dimethyl-4-oxo-1-cyclohex-2-enecarboxylic acid ethyl ester
Alternate Name(s) 2-formyl-4-keto-1,3-dimethyl-cyclohex-2-ene-1-carboxylic acid ethyl ester Ethyl 2-formyl-1,3-dimethyl-4-oxo-cyclohex-2-ene-1-carboxylate Ethyl 2-methanoyl-1,3-dimethyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate
CAS Registry Number 95730-69-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-4-16-11(15)12(3)6-5-10(14)8(2)9(12)7-13/h7H,4-6H2,1-3H3
InChIKey GUHIQHVBTAFKQG-UHFFFAOYSA-N
Molecular Weight 224.256 g/mol
SMILES C1(CCC(C(=C1C=O)C)=O)(C(=O)OCC)C
SPLASH splash10-004i-9500000000-ad06089db1b20400b332
Wiley ID 1471231