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1-Ethyl 5-Methyl (E)-3-(Prop-1-enyl)pentanedioate
SpectraBase Compound ID IXX6qYfq7FG
InChI InChI=1S/C11H18O4/c1-4-6-9(7-10(12)14-3)8-11(13)15-5-2/h4,6,9H,5,7-8H2,1-3H3/b6-4+
InChIKey HXKONVPXKFYFHB-GQCTYLIASA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6IXHzI82RtM
Name 1-Ethyl 5-Methyl (E)-3-(Prop-1-enyl)pentanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-4-6-9(7-10(12)14-3)8-11(13)15-5-2/h4,6,9H,5,7-8H2,1-3H3/b6-4+
InChIKey HXKONVPXKFYFHB-GQCTYLIASA-N
Molecular Weight 214.261 g/mol
SMILES C(CC(CC(=O)OC)\C=C\C)(=O)OCC
SPLASH splash10-067u-6900000000-a7169431915483f423d9
Source of Spectrum U1-2012-5824-15a
Synonyms 3-[(E)-prop-1-enyl]pentanedioic acid O1-ethyl ester O5-methyl ester 1-O-ethyl 5-O-methyl 3-[(E)-prop-1-enyl]pentanedioate O1-ethyl O5-methyl 3-[(E)-prop-1-enyl]pentanedioate
Wiley ID 1715687