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4-[carbobenzoxy-[(E)-2-tosylvinyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID KC0DTdofTIF
InChI InChI=1S/C27H25NO8S/c1-19-9-12-22(13-10-19)37(32,33)16-15-28(27(31)36-18-20-7-5-4-6-8-20)24-14-11-21(25(29)34-2)17-23(24)26(30)35-3/h4-17H,18H2,1-3H3/b16-15+
InChIKey ZQAGJKIKPWOXDZ-FOCLMDBBSA-N
Mol Weight 523.56 g/mol
Molecular Formula C27H25NO8S
Exact Mass 523.130088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fo4Jzgck928
Name 4-[carbobenzoxy-[(E)-2-tosylvinyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester
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Formula C27H25NO8S
InChI InChI=1S/C27H25NO8S/c1-19-9-12-22(13-10-19)37(32,33)16-15-28(27(31)36-18-20-7-5-4-6-8-20)24-14-11-21(25(29)34-2)17-23(24)26(30)35-3/h4-17H,18H2,1-3H3/b16-15+
InChIKey ZQAGJKIKPWOXDZ-FOCLMDBBSA-N
Molecular Weight 523.556 g/mol
SMILES c1(c(N(\C=C\S(c2ccc(cc2)C)(=O)=O)C(OCc2ccccc2)=O)ccc(c1)C(=O)OC)C(=O)OC
SPLASH splash10-0006-9001000000-dd46b7847ad05631c9f4
Source of Spectrum F-68-2231-33
Synonyms 4-[[(E)-2-(4-methylphenyl)sulfonylethenyl]-phenylmethoxycarbonylamino]benzene-1,3-dicarboxylic acid dimethyl ester Dimethyl 4-[benzyloxycarbonyl-[(E)-2-(p-tolylsulfonyl)vinyl]amino]benzene-1,3-dicarboxylate Dimethyl 4-[[(E)-2-(4-methylphenyl)sulfonylethenyl]-phenylmethoxycarbonyl-amino]benzene-1,3-dicarboxylate
Wiley ID 1571997