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(E)-ethyl 2-butyl-4-methylhepta-2,3,5-trienoate

View entire compound with spectra: 1 MS (GC)

(E)-ethyl 2-butyl-4-methylhepta-2,3,5-trienoate
SpectraBase Compound ID 4uoZ8ZRbcMY
InChI InChI=1S/C14H22O2/c1-5-8-10-13(14(15)16-7-3)11-12(4)9-6-2/h6,9H,5,7-8,10H2,1-4H3/b9-6+
InChIKey ZBMVLODVKPJBKJ-RMKNXTFCSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1HykOGulmJ
Name (E)-ethyl 2-butyl-4-methylhepta-2,3,5-trienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-5-8-10-13(14(15)16-7-3)11-12(4)9-6-2/h6,9H,5,7-8,10H2,1-4H3/b9-6+
InChIKey ZBMVLODVKPJBKJ-RMKNXTFCSA-N
Literature Reference DOI 10.1021/ol102989q
Molecular Weight 222.328 g/mol
SMILES C(CCCC)(=C=C(C)\C=C\C)C(OCC)=O
SPLASH splash10-0a4l-4900000000-4abd2a9736e8e0ae6d55
Source of Spectrum A1-13-748/SM10-3ab
Wiley ID 1749891