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3-({[(1-acetyl-1H-benzimidazol-2-yl)sulfanyl]acetyl}amino)benzoic acid
SpectraBase Compound ID 1BnIT39128H
InChI InChI=1S/C18H15N3O4S/c1-11(22)21-15-8-3-2-7-14(15)20-18(21)26-10-16(23)19-13-6-4-5-12(9-13)17(24)25/h2-9H,10H2,1H3,(H,19,23)(H,24,25)
InChIKey QAPGCDMPVQUPHX-UHFFFAOYSA-N
Mol Weight 369.4 g/mol
Molecular Formula C18H15N3O4S
Exact Mass 369.078327 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3XNwZyXBLE
Name 3-({[(1-acetyl-1H-benzimidazol-2-yl)sulfanyl]acetyl}amino)benzoic acid
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/C18H15N3O4S/c1-11(22)21-15-8-3-2-7-14(15)20-18(21)26-10-16(23)19-13-6-4-5-12(9-13)17(24)25/h2-9H,10H2,1H3,(H,19,23)(H,24,25)
InChIKey QAPGCDMPVQUPHX-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9488
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: UZI/9045214; UBI_ID: UBI-009491
Temperature 308 °C