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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 D72Vzze4cGC
Name trans-3-octenoic acid-ethyl ester
Alternate Name(s) Ethyl (E)-oct-3-enoate
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
Literature Reference DOI 10.1002/hlca.19710540715
Molecular Weight 170.252 g/mol
SMILES C(C)CC\C=C\CC(OCC)=O
SPLASH splash10-0a6r-9000000000-a56d699bf97d30b2dce4
Source of Spectrum H-54-1888-1888_6
Wiley ID 1799829