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N-[2-[3-Chloro-1,4-naphthoquinonyl]-.alpha.-amino-p-toluenesulfonamide

View entire compound with spectra: 1 NMR

N-[2-[3-Chloro-1,4-naphthoquinonyl]-.alpha.-amino-p-toluenesulfonamide
SpectraBase Compound ID DBXXoic2pjo
InChI InChI=1S/C17H13ClN2O4S/c18-14-15(17(22)13-4-2-1-3-12(13)16(14)21)20-9-10-5-7-11(8-6-10)25(19,23)24/h1-8,20H,9H2,(H2,19,23,24)
InChIKey IUNUCHIQJXGRCG-UHFFFAOYSA-N
Mol Weight 376.81 g/mol
Molecular Formula C17H13ClN2O4S
Exact Mass 376.028456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5c4ASFIJfje
Name N-[2-[3-Chloro-1,4-naphthoquinonyl]-.alpha.-amino-p-toluenesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 376.028455777 u
Formula C17H13ClN2O4S
InChI InChI=1S/C17H13ClN2O4S/c18-14-15(17(22)13-4-2-1-3-12(13)16(14)21)20-9-10-5-7-11(8-6-10)25(19,23)24/h1-8,20H,9H2,(H2,19,23,24)
InChIKey IUNUCHIQJXGRCG-UHFFFAOYSA-N
Molecular Weight 376.814 g/mol
SMILES C1(S(=O)(N)=O)=CC=C(C=C1)CNC1=C(C(=O)C=2C(C1=O)=CC=CC2)Cl