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(2E)-2-Hexenoic acid
SpectraBase Compound ID 5Q5j9CSaSF3
InChI InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+
InChIKey NIONDZDPPYHYKY-SNAWJCMRSA-N
Mol Weight 114.14 g/mol
Molecular Formula C6H10O2
Exact Mass 114.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FWI8zAo4fxI
Name (2E)-Hexenoic acid
CAS Registry Number 13419-69-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+
InChIKey NIONDZDPPYHYKY-SNAWJCMRSA-N
Molecular Weight 114.144 g/mol
SMILES OC(\C=C\CCC)=O
SPLASH splash10-006x-9000000000-a953166b29e4957aa7b7
Source ex BEDOUKIAN RES.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Hexenoic acid<2E->
Wiley ID 1887477