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3-Octenoic acid, ethyl ester
SpectraBase Compound ID JwbdtKu8fuO
InChI InChI=1S/C10H18O2/c1-3-5-6-7-8-9-10(11)12-4-2/h7-8H,3-6,9H2,1-2H3/b8-7+
InChIKey BCMYNNIPTQUKAC-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 GqZCVJGGOQ1
Name 3-Octenoic acid, ethyl ester
CAS Registry Number 1117-65-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-3-5-6-7-8-9-10(11)12-4-2/h7-8H,3-6,9H2,1-2H3/b8-7+
InChIKey BCMYNNIPTQUKAC-BQYQJAHWSA-N
Molecular Weight 170.252 g/mol
SMILES C(C\C=C\CCCC)(=O)OCC
SPLASH splash10-0a4l-9100000000-aee6b32eda93d422a4ef
Source of Spectrum KC-0-3532-0
Synonyms Ethyl (E)-Oct-3-enoate (E)-3-octenoic acid ethyl ester (E)-oct-3-enoic acid ethyl ester Ethyl (3E)-3-octenoate Ethyl 3-octenoate Ethyl cis-3-octenoate Ethyl oct-3-enoate
Wiley ID 826816