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N-(2-Methylphenyl)-3-nitrobenzenesulfonamide
SpectraBase Compound ID G0ax7JrOuba
InChI InChI=1S/C13H12N2O4S/c1-10-5-2-3-8-13(10)14-20(18,19)12-7-4-6-11(9-12)15(16)17/h2-9,14H,1H3
InChIKey SZBNIELWCMBOEY-UHFFFAOYSA-N
Mol Weight 292.31 g/mol
Molecular Formula C13H12N2O4S
Exact Mass 292.051778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EbZF8tmjAGt
Name N-(2-Methylphenyl)-3-nitrobenzenesulfonamide
Comments Computed using HOSE algorithm
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Exact Mass 292.051778044 u
Formula C13H12N2O4S
InChI InChI=1S/C13H12N2O4S/c1-10-5-2-3-8-13(10)14-20(18,19)12-7-4-6-11(9-12)15(16)17/h2-9,14H,1H3
InChIKey SZBNIELWCMBOEY-UHFFFAOYSA-N
SMILES C1(NS(=O)(=O)C2=CC(=CC=C2)N(=O)=O)=C(C=CC=C1)C