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(Toluene-4-sulfonylamino)acetic acid, 4-hydroxybut-2-enyl ester
SpectraBase Compound ID 7QkJK4jBcd2
InChI InChI=1S/C13H17NO5S/c1-11-4-6-12(7-5-11)20(17,18)14-10-13(16)19-9-3-2-8-15/h2-7,14-15H,8-10H2,1H3/b3-2-
InChIKey MIYUCYBZHQDZRJ-IHWYPQMZSA-N
Mol Weight 299.34 g/mol
Molecular Formula C13H17NO5S
Exact Mass 299.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFEcjehXDOS
Name (Toluene-4-sulfonylamino)acetic acid, 4-hydroxybut-2-enyl ester
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Formula C13H17NO5S
InChI InChI=1S/C13H17NO5S/c1-11-4-6-12(7-5-11)20(17,18)14-10-13(16)19-9-3-2-8-15/h2-7,14-15H,8-10H2,1H3/b3-2-
InChIKey MIYUCYBZHQDZRJ-IHWYPQMZSA-N
Molecular Weight 299.341 g/mol
SMILES N(S(c1ccc(C)cc1)(=O)=O)CC(OC\C=C/CO)=O
SPLASH splash10-0536-9600000000-5ee764994d7d68761e36
Synonyms 2-[(4-methylphenyl)sulfonylamino]acetic acid [(Z)-4-hydroxybut-2-enyl] ester [(Z)-4-hydroxybut-2-enyl] 2-[(4-methylphenyl)sulfonylamino]acetate [(Z)-4-hydroxybut-2-enyl] 2-(p-tolylsulfonylamino)acetate [(Z)-4-oxidanylbut-2-enyl] 2-[(4-methylphenyl)sulfonylamino]ethanoate
Wiley ID 1483856