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Methyl trans-2-octenoate
SpectraBase Compound ID 6BBZhwH98h
InChI InChI=1S/C9H16O2/c1-3-4-5-6-7-8-9(10)11-2/h7-8H,3-6H2,1-2H3/b8-7+
InChIKey CJBQSBZJDJHMLF-BQYQJAHWSA-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 2ziH2rFad1j
Name (E)-Methyl 2-octenoate
CAS Registry Number 7367-81-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
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/C9H16O2/c1-3-4-5-6-7-8-9(10)11-2/h7-8H,3-6H2,1-2H3/b8-7+
InChIKey CJBQSBZJDJHMLF-BQYQJAHWSA-N
Molecular Weight 156.225 g/mol
SMILES C(\C=C\C(OC)=O)CCCC
SPLASH splash10-0a4u-9200000000-faeb5b4bca7a607f8e4c
Source ex BEDOUKIAN RES.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Methyl 2-octenoate
Wiley ID 1887624