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3-Ethoxy-1-(2-keto-2-methoxy-ethyl)cyclohexa-2,5-diene-1-carboxylic acid methyl ester
SpectraBase Compound ID 1rzSgZZH79Z
InChI InChI=1S/C13H18O5/c1-4-18-10-6-5-7-13(8-10,12(15)17-3)9-11(14)16-2/h5,7-8H,4,6,9H2,1-3H3
InChIKey GQQMVEIWWYERGJ-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jxi9ohoT6qd
Name 3-Ethoxy-1-(2-keto-2-methoxy-ethyl)cyclohexa-2,5-diene-1-carboxylic acid methyl ester
Alternate Name(s) 3-Ethoxy-1-(2-methoxy-2-oxoethyl)-1-cyclohexa-2,5-dienecarboxylic acid methyl ester Methyl 3-ethoxy-1-(2-methoxy-2-oxidanylidene-ethyl)cyclohexa-2,5-diene-1-carboxylate Methyl 3-ethoxy-1-(2-methoxy-2-oxo-ethyl)cyclohexa-2,5-diene-1-carboxylate
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Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-4-18-10-6-5-7-13(8-10,12(15)17-3)9-11(14)16-2/h5,7-8H,4,6,9H2,1-3H3
InChIKey GQQMVEIWWYERGJ-UHFFFAOYSA-N
Molecular Weight 254.282 g/mol
SMILES C1(C=C(OCC)CC=C1)(C(=O)OC)CC(=O)OC
SPLASH splash10-000j-0900000000-0e5a5fc452bf54aa08a0
Source of Spectrum SK-31-457-2
Wiley ID 881828