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3-Chloranyl-N-phenyl-benzo[g][1]benzothiole-2-carboxamide

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

3-Chloranyl-N-phenyl-benzo[g][1]benzothiole-2-carboxamide
SpectraBase Compound ID 1Q7EhNw0V3P
InChI InChI=1S/C19H12ClNOS/c20-16-15-11-10-12-6-4-5-9-14(12)17(15)23-18(16)19(22)21-13-7-2-1-3-8-13/h1-11H,(H,21,22)
InChIKey VKMGGXRDATZRAV-UHFFFAOYSA-N
Mol Weight 337.82 g/mol
Molecular Formula C19H12ClNOS
Exact Mass 337.032813 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2c1uGGq0FJh
Name 3-Chloranyl-N-phenyl-benzo[G][1]benzothiole-2-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.032812883 u
Formula C19H12ClNOS
InChI InChI=1S/C19H12ClNOS/c20-16-15-11-10-12-6-4-5-9-14(12)17(15)23-18(16)19(22)21-13-7-2-1-3-8-13/h1-11H,(H,21,22)
InChIKey VKMGGXRDATZRAV-UHFFFAOYSA-N
Molecular Weight 337.824 g/mol
SMILES C=1(SC2=C3C(C=CC=C3)=CC=C2C1Cl)C(NC1=CC=CC=C1)=O