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4-Heptenoic acid, ethyl ester, (E)-
SpectraBase Compound ID 53mpUkTudPa
InChI InChI=1S/C9H16O2/c1-3-5-6-7-8-9(10)11-4-2/h5-6H,3-4,7-8H2,1-2H3/b6-5+
InChIKey GITGIBUELGTBSG-AATRIKPKSA-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 3HlPTqivG3x
Name 4-Heptenoic acid, ethyl ester, (E)-
CAS Registry Number 54340-70-4
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/h5-6H,3-4,7-8H2,1-2H3/b6-5+
InChIKey GITGIBUELGTBSG-AATRIKPKSA-N
Molecular Weight 156.225 g/mol
SMILES CCOC(=O)CC\C=C\CC
SPLASH splash10-014i-9000000000-cff717cac7d36c0f2f8c
Source of Spectrum AD-0-3491-0
Synonyms Ethyl (4E)-4-heptenoate (E)-4-heptenoic acid ethyl ester (E)-hept-4-enoic acid ethyl ester Ethyl (E)-hept-4-enoate EINECS 259-113-0
Wiley ID 11751