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(E)-2-[(Phenyl)(toluene-4-sulfonylamino)methyl]but-2-enoic acid naphthalen-1-yl ester
SpectraBase Compound ID CPAdkEIG6JU
InChI InChI=1S/C28H25NO4S/c1-3-24(28(30)33-26-15-9-13-21-10-7-8-14-25(21)26)27(22-11-5-4-6-12-22)29-34(31,32)23-18-16-20(2)17-19-23/h3-19,27,29H,1-2H3/b24-3+
InChIKey BAQQSZXUAWGAJA-QHVLENNUSA-N
Mol Weight 471.57 g/mol
Molecular Formula C28H25NO4S
Exact Mass 471.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J44ayayREOn
Name (E)-2-[(Phenyl)(toluene-4-sulfonylamino)methyl]but-2-enoic acid naphthalen-1-yl ester
Comments Less than 3 mono-isotopic peaks
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Formula C28H25NO4S
InChI InChI=1S/C28H25NO4S/c1-3-24(28(30)33-26-15-9-13-21-10-7-8-14-25(21)26)27(22-11-5-4-6-12-22)29-34(31,32)23-18-16-20(2)17-19-23/h3-19,27,29H,1-2H3/b24-3+
InChIKey BAQQSZXUAWGAJA-QHVLENNUSA-N
Molecular Weight 471.571 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(\C(C(Oc1c2c(cccc2)ccc1)=O)=C/C)c1ccccc1
SPLASH splash10-00di-0900000000-17d4d76cd6b307324d30
Source of Spectrum F-62-470-5
Synonyms 1-naphthyl (2E)-2-[{[(4-methylphenyl)sulfonyl]amino}(phenyl)methyl]-2-butenoate
Wiley ID 1631869