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(E)-Ethyl 2-Chloro-4-phenylbut-2,4-dienoate
SpectraBase Compound ID 6dauGGvuwoU
InChI InChI=1S/C13H13ClO2/c1-2-16-13(15)12(14)10-6-9-11-7-4-3-5-8-11/h3-10H,2H2,1H3/b9-6+,12-10+
InChIKey IIPHLOPFGHPBPX-LWGDNYCUSA-N
Mol Weight 236.7 g/mol
Molecular Formula C13H13ClO2
Exact Mass 236.060407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3oLdmnNmi0
Name (E)-Ethyl 2-Chloro-4-phenylbut-2,4-dienoate
Alternate Name(s) (2E,4E)-2-Chloro-5-phenyl-penta-2,4-dienoic acid ethyl ester (E)-Ethyl 2-Chloro-5-phenyl-pent-2,4-dienoate (2E,4E)-2-chloro-5-phenylpenta-2,4-dienoic acid ethyl ester Ethyl (2E,4E)-2-chloro-5-phenylpenta-2,4-dienoate Ethyl (2E,4E)-2-chloro-5-phenyl-penta-2,4-dienoate Ethyl (2E,4E)-2-chloranyl-5-phenyl-penta-2,4-dienoate
CAS Registry Number 125285-95-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClO2
InChI InChI=1S/C13H13ClO2/c1-2-16-13(15)12(14)10-6-9-11-7-4-3-5-8-11/h3-10H,2H2,1H3/b9-6+,12-10+
InChIKey IIPHLOPFGHPBPX-LWGDNYCUSA-N
Molecular Weight 236.698 g/mol
SMILES C(\C(=C/C=C/c1ccccc1)Cl)(=O)OCC
SPLASH splash10-004i-2930000000-0afa4b1d5d3261f050ac
Source of Spectrum SO-0-982-3
Wiley ID 876757