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2-Methyl-5-nitro-N-[4-(4-pyridylmethyl)phenyl]benzenesulfonamide

View entire compound with spectra: 2 NMR, and 1 MS (GC)

2-Methyl-5-nitro-N-[4-(4-pyridylmethyl)phenyl]benzenesulfonamide
SpectraBase Compound ID 2Z7TiHImnzw
InChI InChI=1S/C19H17N3O4S/c1-14-2-7-18(22(23)24)13-19(14)27(25,26)21-17-5-3-15(4-6-17)12-16-8-10-20-11-9-16/h2-11,13,21H,12H2,1H3
InChIKey MNVGFHVWHQOMOJ-UHFFFAOYSA-N
Mol Weight 383.42 g/mol
Molecular Formula C19H17N3O4S
Exact Mass 383.093977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BM5G4dWpaQd
Name 2-Methyl-5-nitro-N-[4-(4-pyridylmethyl)phenyl]benzenesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 383.093977209 u
Formula C19H17N3O4S
InChI InChI=1S/C19H17N3O4S/c1-14-2-7-18(22(23)24)13-19(14)27(25,26)21-17-5-3-15(4-6-17)12-16-8-10-20-11-9-16/h2-11,13,21H,12H2,1H3
InChIKey MNVGFHVWHQOMOJ-UHFFFAOYSA-N
Molecular Weight 383.422 g/mol
SMILES C1=CN=CC=C1CC=1C=CC(NS(C=2C=C(N(=O)=O)C=CC2C)(=O)=O)=CC1