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(E)-2-[(phenyl)(toluene-4-sulfonylamino)methyl]penta-2,4-dienoic acid phenyl ester
SpectraBase Compound ID Fh8KqRFolVE
InChI InChI=1S/C25H23NO4S/c1-3-10-23(25(27)30-21-13-8-5-9-14-21)24(20-11-6-4-7-12-20)26-31(28,29)22-17-15-19(2)16-18-22/h3-18,24,26H,1H2,2H3/b23-10+
InChIKey XJBUIFCTVKCDLN-AUEPDCJTSA-N
Mol Weight 433.52 g/mol
Molecular Formula C25H23NO4S
Exact Mass 433.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1aJkZIlpUpT
Name (E)-2-[(phenyl)(toluene-4-sulfonylamino)methyl]penta-2,4-dienoic acid phenyl ester
Alternate Name(s) phenyl (2E)-2-[{[(4-methylphenyl)sulfonyl]amino}(phenyl)methyl]-2,4-pentadienoate
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Formula C25H23NO4S
InChI InChI=1S/C25H23NO4S/c1-3-10-23(25(27)30-21-13-8-5-9-14-21)24(20-11-6-4-7-12-20)26-31(28,29)22-17-15-19(2)16-18-22/h3-18,24,26H,1H2,2H3/b23-10+
InChIKey XJBUIFCTVKCDLN-AUEPDCJTSA-N
Molecular Weight 433.522 g/mol
SMILES N(C(\C(C(=O)Oc1ccccc1)=C/C=C)c1ccccc1)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0006-9004000000-442d2ddf97c6dfa88630
Source of Spectrum F-62-473-8
Wiley ID 1631852