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3-Heptenoic acid, 7-phenyl-, ethyl ester, (E)-
SpectraBase Compound ID HbxVnidyBhQ
InChI InChI=1S/C15H20O2/c1-2-17-15(16)13-9-4-3-6-10-14-11-7-5-8-12-14/h4-5,7-9,11-12H,2-3,6,10,13H2,1H3/b9-4+
InChIKey HTMZPFDQPSPNIH-RUDMXATFSA-N
Mol Weight 232.32 g/mol
Molecular Formula C15H20O2
Exact Mass 232.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lGahQjEhWQ
Name 3-Heptenoic acid, 7-phenyl-, ethyl ester, (E)-
CAS Registry Number 72178-97-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O2
InChI InChI=1S/C15H20O2/c1-2-17-15(16)13-9-4-3-6-10-14-11-7-5-8-12-14/h4-5,7-9,11-12H,2-3,6,10,13H2,1H3/b9-4+
InChIKey HTMZPFDQPSPNIH-RUDMXATFSA-N
Molecular Weight 232.323 g/mol
SMILES c1cc(ccc1)CCC\C=C\CC(=O)OCC
SPLASH splash10-0f6x-4900000000-89448b452f896d36288f
Source of Spectrum H-62-1930-0
Synonyms Ethyl (3E)-7-phenyl-3-heptenoate (E)-7-phenyl-3-heptenoic acid ethyl ester (E)-7-phenylhept-3-enoic acid ethyl ester Ethyl (E)-7-phenylhept-3-enoate
Wiley ID 1234107