For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-Hexenoic acid, 2,4-dioxo-6-phenyl-, ethyl ester
SpectraBase Compound ID Cke4JCMVb0j
InChI InChI=1S/C14H14O4/c1-2-18-14(17)13(16)10-12(15)9-8-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3/b9-8+
InChIKey ZYTPZSVMXSYIFE-CMDGGOBGSA-N
Mol Weight 246.26 g/mol
Molecular Formula C14H14O4
Exact Mass 246.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LW1bxphllqs
Name 5-Hexenoic acid, 2,4-dioxo-6-phenyl-, ethyl ester
Alternate Name(s) (E)-2,4-diketo-6-phenyl-hex-5-enoic acid ethyl ester (E)-2,4-dioxo-6-phenyl-5-hexenoic acid ethyl ester Ethyl (5E)-2,4-dioxo-6-phenyl-5-hexenoate Ethyl (E)-2,4-bis(oxidanylidene)-6-phenyl-hex-5-enoate Ethyl (E)-2,4-dioxo-6-phenyl-hex-5-enoate Ethyl 2,4-dioxo-6-phenylhex-5-enoate
CAS Registry Number 1027-41-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O4
InChI InChI=1S/C14H14O4/c1-2-18-14(17)13(16)10-12(15)9-8-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3/b9-8+
InChIKey ZYTPZSVMXSYIFE-CMDGGOBGSA-N
Molecular Weight 246.262 g/mol
SMILES C(C(CC(\C=C\c1ccccc1)=O)=O)(=O)OCC
SPLASH splash10-0v6r-7900000000-a7473d1385e6bdd7bb3a
Source of Spectrum KC-0-166-7
Wiley ID 787153