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2-Heptenoic acid, ethyl ester, (E)-
SpectraBase Compound ID 8tOBa0dXlao
InChI InChI=1S/C9H16O2/c1-3-5-6-7-8-9(10)11-4-2/h7-8H,3-6H2,1-2H3/b8-7+
InChIKey CYLQPOIZDBIXFP-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 DkskMAFQZqC
Name 2-Heptenoic acid, ethyl ester, (E)-
Alternate Name(s) (E)-2-heptenoic acid ethyl ester Ethyl (2E)-2-heptenoate (E)-hept-2-enoic acid ethyl ester Ethyl (E)-hept-2-enoate
CAS Registry Number 54340-72-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-3-5-6-7-8-9(10)11-4-2/h7-8H,3-6H2,1-2H3/b8-7+
InChIKey CYLQPOIZDBIXFP-BQYQJAHWSA-N
Molecular Weight 156.225 g/mol
SMILES C(\C=C\C(=O)OCC)CCC
SPLASH splash10-0a4l-9200000000-cb9f9e8a1159667996c9
Source of Spectrum AD-0-3489-0
Wiley ID 11755