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2-[(E)-5-methyl-6-oxooct-2-enyl]propanedioic acid dimethyl ester
SpectraBase Compound ID 2LyWYFzcxhA
InChI InChI=1S/C14H22O5/c1-5-12(15)10(2)8-6-7-9-11(13(16)18-3)14(17)19-4/h6-7,10-11H,5,8-9H2,1-4H3/b7-6+
InChIKey GVKHAHBJEWVEBD-VOTSOKGWSA-N
Mol Weight 270.32 g/mol
Molecular Formula C14H22O5
Exact Mass 270.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3SxMu9g4Nf
Name 2-[(E)-5-methyl-6-oxooct-2-enyl]propanedioic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O5
InChI InChI=1S/C14H22O5/c1-5-12(15)10(2)8-6-7-9-11(13(16)18-3)14(17)19-4/h6-7,10-11H,5,8-9H2,1-4H3/b7-6+
InChIKey GVKHAHBJEWVEBD-VOTSOKGWSA-N
Molecular Weight 270.325 g/mol
SMILES C(C(=O)OC)(C(=O)OC)C\C=C\CC(C(=O)CC)C
SPLASH splash10-0a5i-9600000000-e8ca5a49cf999339aee0
Source of Spectrum J-60-4957-4
Synonyms 2-[(E)-6-keto-5-methyl-oct-2-enyl]malonic acid dimethyl ester Dimethyl 2-[(E)-5-methyl-6-oxidanylidene-oct-2-enyl]propanedioate Dimethyl 2-[(E)-5-methyl-6-oxo-oct-2-enyl]propanedioate
Wiley ID 1274037