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2-Hexenoic acid, butyl ester, (E)-
SpectraBase Compound ID 2UwOAQFCTC3
InChI InChI=1S/C10H18O2/c1-3-5-7-8-10(11)12-9-6-4-2/h7-8H,3-6,9H2,1-2H3/b8-7+
InChIKey OPVSKLFHWQRZKR-BQYQJAHWSA-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 8Wh00nEiRUR
Name 2-Hexenoic acid, butyl ester, (E)-
CAS Registry Number 54411-16-4
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/h7-8H,3-6,9H2,1-2H3/b8-7+
InChIKey OPVSKLFHWQRZKR-BQYQJAHWSA-N
Molecular Weight 170.252 g/mol
SMILES CCCCOC(=O)\C=C\CCC
SPLASH splash10-066s-9300000000-89c02c43282011c8dba2
Source of Spectrum AA-0-1132-1
Synonyms Butyl (2E)-2-hexenoate (E)-2-hexenoic acid butyl ester (E)-hex-2-enoic acid butyl ester Butyl (E)-hex-2-enoate
Wiley ID 15621