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trans-3-Octenoic acid, methyl ester

View entire compound with spectra: 3 NMR, and 3 MS (GC)

trans-3-Octenoic acid, methyl ester
SpectraBase Compound ID EKTIdDoo151
InChI InChI=1S/C9H16O2/c1-3-4-5-6-7-8-9(10)11-2/h6-7H,3-5,8H2,1-2H3/b7-6+
InChIKey HAGXFSMJELVHFJ-VOTSOKGWSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 97wggkxXRE3
Name trans-3-octenoic acid-methylester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-3-4-5-6-7-8-9(10)11-2/h6-7H,3-5,8H2,1-2H3/b7-6+
InChIKey HAGXFSMJELVHFJ-VOTSOKGWSA-N
Literature Reference DOI 10.1002/hlca.19710540715
Molecular Weight 156.225 g/mol
SMILES CCCC\C=C\CC(OC)=O
SPLASH splash10-0a6r-9100000000-1eed517d5d022954fa2c
Source of Spectrum H-54-1888-1888_4
Synonyms Methyl (E)-oct-3-enoate
Wiley ID 1799827