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Benzenesulfenamide, N-(2-methylphenyl)-4-nitro-
SpectraBase Compound ID 2QeSlxjAGO5
InChI InChI=1S/C13H12N2O2S/c1-10-4-2-3-5-13(10)14-18-12-8-6-11(7-9-12)15(16)17/h2-9,14H,1H3
InChIKey KTJCSNSMGNYJBN-UHFFFAOYSA-N
Mol Weight 260.31 g/mol
Molecular Formula C13H12N2O2S
Exact Mass 260.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKXEzeaUTRK
Name Benzenesulfenamide, N-(2-methylphenyl)-4-nitro-
Alternate Name(s) 1-methyl-2-{[(4-nitrophenyl)sulfanyl]amino}benzene N-(2-methylphenyl)-S-(4-nitrophenyl)thiohydroxylamine N-(o-methylphenyl)-4-nitrobenzenesulphenamide
CAS Registry Number 125771-30-4
Comments Less than 3 mono-isotopic peaks
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Formula C13H12N2O2S
InChI InChI=1S/C13H12N2O2S/c1-10-4-2-3-5-13(10)14-18-12-8-6-11(7-9-12)15(16)17/h2-9,14H,1H3
InChIKey KTJCSNSMGNYJBN-UHFFFAOYSA-N
Molecular Weight 260.311 g/mol
SMILES N(Sc1ccc(N(=O)=O)cc1)c1c(C)cccc1
SPLASH splash10-0a4i-0930000000-523bb2081a3526fe5ada
Source of Spectrum O-24-927-11
Wiley ID 1263491