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3-Hexenoic acid, butyl ester, (Z)-
SpectraBase Compound ID 9iTWBN8fx6F
InChI InChI=1S/C10H18O2/c1-3-5-7-8-10(11)12-9-6-4-2/h5,7H,3-4,6,8-9H2,1-2H3/b7-5-
InChIKey XZKZOAYDHBSAQW-ALCCZGGFSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7z4Nq0df6tD
Name 3-Hexenoic acid, butyl ester, (Z)-
CAS Registry Number 69668-84-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-3-5-7-8-10(11)12-9-6-4-2/h5,7H,3-4,6,8-9H2,1-2H3/b7-5-
InChIKey XZKZOAYDHBSAQW-ALCCZGGFSA-N
Molecular Weight 170.252 g/mol
SMILES CCCCOC(=O)C\C=C/CC
SPLASH splash10-05ox-9000000000-c846f1c8b3b72adc2471
Source of Spectrum LQ-1992-220-0
Synonyms Butyl (3Z)-3-hexenoate (Z)-3-hexenoic acid butyl ester (Z)-hex-3-enoic acid butyl ester Butyl (Z)-hex-3-enoate
Wiley ID 1166846