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Dimethyl (E)-2-(Diethoxyphosphoryl)-3-[(4-methylphenyl)sulfonyl]-2-butenedioate
SpectraBase Compound ID 6mS89NmMp5Y
InChI InChI=1S/C17H23O9PS/c1-6-25-27(20,26-7-2)14(16(18)23-4)15(17(19)24-5)28(21,22)13-10-8-12(3)9-11-13/h8-11H,6-7H2,1-5H3/b15-14+
InChIKey QMCUHLVLSVXOHO-CCEZHUSRSA-N
Mol Weight 434.4 g/mol
Molecular Formula C17H23O9PS
Exact Mass 434.08004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IknJwrvShKN
Name Dimethyl (E)-2-(Diethoxyphosphoryl)-3-[(4-methylphenyl)sulfonyl]-2-butenedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23O9PS
InChI InChI=1S/C17H23O9PS/c1-6-25-27(20,26-7-2)14(16(18)23-4)15(17(19)24-5)28(21,22)13-10-8-12(3)9-11-13/h8-11H,6-7H2,1-5H3/b15-14+
InChIKey QMCUHLVLSVXOHO-CCEZHUSRSA-N
Molecular Weight 434.396 g/mol
SMILES c1(S(\C(=C/(P(=O)(OCC)OCC)C(=O)OC)C(=O)OC)(=O)=O)ccc(cc1)C
SPLASH splash10-000i-8509300000-79389cc5e45976f88d42
Source of Spectrum F4-40-3450-4l
Synonyms (E)-2-diethoxyphosphoryl-3-(4-methylphenyl)sulfonyl-2-butenedioic acid dimethyl ester Dimethyl (E)-2-diethoxyphosphoryl-3-(4-methylphenyl)sulfonylbut-2-enedioate Dimethyl (E)-2-diethoxyphosphoryl-3-(p-tolylsulfonyl)but-2-enedioate Dimethyl (E)-2-diethoxyphosphoryl-3-(4-methylphenyl)sulfonyl-but-2-enedioate
Wiley ID 1671166