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2-Butenoic acid, 3-(4-chlorophenyl)-4-(dimethoxyphosphinyl)-, ethyl ester
SpectraBase Compound ID 1HER9SHTrqy
InChI InChI=1S/C14H18ClO5P/c1-4-20-14(16)9-12(10-21(17,18-2)19-3)11-5-7-13(15)8-6-11/h5-9H,4,10H2,1-3H3/b12-9-
InChIKey PHGGSSDVYVXRKK-XFXZXTDPSA-N
Mol Weight 332.72 g/mol
Molecular Formula C14H18ClO5P
Exact Mass 332.058038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jufv3jt25qY
Name 2-Butenoic acid, 3-(4-chlorophenyl)-4-(dimethoxyphosphinyl)-, ethyl ester
Alternate Name(s) Ethyl (2E)-3-(4-chlorophenyl)-4-(dimethoxyphosphoryl)-2-butenoate Ethyl 3-(4-chlorophenyl)-4-dimethoxyphosphinylbut-2-enoate
CAS Registry Number 114566-95-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18ClO5P
InChI InChI=1S/C14H18ClO5P/c1-4-20-14(16)9-12(10-21(17,18-2)19-3)11-5-7-13(15)8-6-11/h5-9H,4,10H2,1-3H3/b12-9-
InChIKey PHGGSSDVYVXRKK-XFXZXTDPSA-N
Molecular Weight 332.720 g/mol
SMILES C(P(=O)(OC)OC)\C(=C\C(=O)OCC)c1ccc(cc1)Cl
SPLASH splash10-05di-0590000000-ac01e0722fd4f1f2b116
Source of Spectrum B-40-1515-6
Wiley ID 1329057