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Phenyl (2E)-3-Phenyl-2-[(toluene-4-sulfonylamino)methyl]acrylate
SpectraBase Compound ID 8eznf7ijbWa
InChI InChI=1S/C23H21NO4S/c1-18-12-14-22(15-13-18)29(26,27)24-17-20(16-19-8-4-2-5-9-19)23(25)28-21-10-6-3-7-11-21/h2-16,24H,17H2,1H3/b20-16+
InChIKey XPLIKOUTIBWMSA-CAPFRKAQSA-N
Mol Weight 407.48 g/mol
Molecular Formula C23H21NO4S
Exact Mass 407.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73HE899HLdv
Name Phenyl (2E)-3-Phenyl-2-[(toluene-4-sulfonylamino)methyl]acrylate
Alternate Name(s) phenyl (2E)-2-({[(4-methylphenyl)sulfonyl]amino}methyl)-3-phenyl-2-propenoate
Comments Less than 3 mono-isotopic peaks
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Formula C23H21NO4S
InChI InChI=1S/C23H21NO4S/c1-18-12-14-22(15-13-18)29(26,27)24-17-20(16-19-8-4-2-5-9-19)23(25)28-21-10-6-3-7-11-21/h2-16,24H,17H2,1H3/b20-16+
InChIKey XPLIKOUTIBWMSA-CAPFRKAQSA-N
Molecular Weight 407.484 g/mol
SMILES N(C\C(C(=O)Oc1ccccc1)=C/c1ccccc1)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0006-0900000000-75733eb3b21b25c2a817
Source of Spectrum F-69-424-13
Wiley ID 1594481