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(E)-methyl 2-butylhepta-2,3,5-trienoate

View entire compound with spectra: 1 MS (GC)

(E)-methyl 2-butylhepta-2,3,5-trienoate
SpectraBase Compound ID LpAAlarkJVe
InChI InChI=1S/C12H18O2/c1-4-6-8-10-11(9-7-5-2)12(13)14-3/h4,6,8H,5,7,9H2,1-3H3/b6-4+
InChIKey LFDHGVQUJUPYMF-GQCTYLIASA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LCzmLg5R8A
Name (E)-methyl 2-butylhepta-2,3,5-trienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-4-6-8-10-11(9-7-5-2)12(13)14-3/h4,6,8H,5,7,9H2,1-3H3/b6-4+
InChIKey LFDHGVQUJUPYMF-GQCTYLIASA-N
Literature Reference DOI 10.1021/ol102989q
Molecular Weight 194.274 g/mol
SMILES C(CCCC)(=C=C\C=C\C)C(OC)=O
SPLASH splash10-0f6x-6900000000-b5c628fbdc9caf195d34
Source of Spectrum A1-13-748/SM12-3fa
Wiley ID 1749898