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2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
SpectraBase Compound ID GjFn7A0zEyf
InChI InChI=1S/C16H11F3N4O3S/c17-16(18,19)9-2-1-3-10(6-9)20-14(24)8-27-15-21-12-5-4-11(23(25)26)7-13(12)22-15/h1-7H,8H2,(H,20,24)(H,21,22)
InChIKey XJBMXIDOMRAJNL-UHFFFAOYSA-N
Mol Weight 396.34 g/mol
Molecular Formula C16H11F3N4O3S
Exact Mass 396.050396 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1Pm1XV1TfNf
Name 2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H11F3N4O3S/c17-16(18,19)9-2-1-3-10(6-9)20-14(24)8-27-15-21-12-5-4-11(23(25)26)7-13(12)22-15/h1-7H,8H2,(H,20,24)(H,21,22)
InChIKey XJBMXIDOMRAJNL-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1363
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: C96054; Labnumber: KUPS-0428; SBI_ID: SBI-001365
Temperature 315 °C