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3-Amino-6-nitro-N-phenyl-4-(phenylthio)-1-benzothiophene-2-carboxamide
SpectraBase Compound ID 3ZfoCjv9S6G
InChI InChI=1S/C21H15N3O3S2/c22-19-18-16(28-15-9-5-2-6-10-15)11-14(24(26)27)12-17(18)29-20(19)21(25)23-13-7-3-1-4-8-13/h1-12H,22H2,(H,23,25)
InChIKey OUPVCLMTQABPOU-UHFFFAOYSA-N
Mol Weight 421.49 g/mol
Molecular Formula C21H15N3O3S2
Exact Mass 421.055484 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GSOhMB0MpEy
Name benzo[b]thiophene-2-carboxamide, 3-amino-6-nitro-N-phenyl-4-(phenylthio)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 421.055483700 u
Formula C21H15N3O3S2
InChI InChI=1S/C21H15N3O3S2/c22-19-18-16(28-15-9-5-2-6-10-15)11-14(24(26)27)12-17(18)29-20(19)21(25)23-13-7-3-1-4-8-13/h1-12H,22H2,(H,23,25)
InChIKey OUPVCLMTQABPOU-UHFFFAOYSA-N
Molecular Weight 421.489 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14917
Solvent DMSO-d6
Source Vendor ID: NMR/10320370; Lab Info: DAL; Lab Number: DAL-01010046