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3-(Benzoxazol-2-ylthio)-N-(4-sulfamoylphenyl)propanamide
SpectraBase Compound ID JIMeOLsuReF
InChI InChI=1S/C16H15N3O4S2/c17-25(21,22)12-7-5-11(6-8-12)18-15(20)9-10-24-16-19-13-3-1-2-4-14(13)23-16/h1-8H,9-10H2,(H,18,20)(H2,17,21,22)
InChIKey JKNPNELLSQGFSW-UHFFFAOYSA-N
Mol Weight 377.43 g/mol
Molecular Formula C16H15N3O4S2
Exact Mass 377.050398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gln7oX5sHWC
Name 3-(Benzoxazol-2-ylthio)-N-(4-sulfamoylphenyl)propanamide
Appearance Solid
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Formula C16H15N3O4S2
InChI InChI=1S/C16H15N3O4S2/c17-25(21,22)12-7-5-11(6-8-12)18-15(20)9-10-24-16-19-13-3-1-2-4-14(13)23-16/h1-8H,9-10H2,(H,18,20)(H2,17,21,22)
InChIKey JKNPNELLSQGFSW-UHFFFAOYSA-N
Instrument Name Thermo Scientific ISQ LT
Ionization Type EI
Literature Reference DOI 10.1002/ardp.201900113
Molecular Weight 377.433 g/mol
SMILES N(C(=O)CCSc1nc2ccccc2o1)c1ccc(S(N)(=O)=O)cc1
SPLASH splash10-004i-0009000000-8ce697dd7e6f0fd909b2
Source of Spectrum APC-352-13-4e
Wiley ID 1839613