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2-Hexenoic acid, 6-phenyl-, methyl ester, (E)-
SpectraBase Compound ID 28eYpBdp9Z1
InChI InChI=1S/C13H16O2/c1-15-13(14)11-7-3-6-10-12-8-4-2-5-9-12/h2,4-5,7-9,11H,3,6,10H2,1H3/b11-7+
InChIKey KZBLVCWGHBYDGQ-YRNVUSSQSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHLFw032TzB
Name 2-Hexenoic acid, 6-phenyl-, methyl ester, (E)-
CAS Registry Number 55283-02-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-15-13(14)11-7-3-6-10-12-8-4-2-5-9-12/h2,4-5,7-9,11H,3,6,10H2,1H3/b11-7+
InChIKey KZBLVCWGHBYDGQ-YRNVUSSQSA-N
Molecular Weight 204.269 g/mol
SMILES COC(=O)\C=C\CCCc1ccccc1
SPLASH splash10-0f6x-6900000000-68ce92de33ce667e2ec0
Source of Spectrum SD-1981-0-0
Synonyms Methyl (2E)-6-phenyl-2-hexenoate (E)-6-phenyl-2-hexenoic acid methyl ester (E)-6-phenylhex-2-enoic acid methyl ester Methyl (E)-6-phenylhex-2-enoate
Wiley ID 1201967