For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,5-bis{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}benzoic acid
SpectraBase Compound ID GVyH7ecwSXL
InChI InChI=1S/C25H20N6O4S2/c32-21(12-36-24-28-17-5-1-2-6-18(17)29-24)26-15-9-14(23(34)35)10-16(11-15)27-22(33)13-37-25-30-19-7-3-4-8-20(19)31-25/h1-11H,12-13H2,(H,26,32)(H,27,33)(H,28,29)(H,30,31)(H,34,35)
InChIKey IWCPNOANUQSFSI-UHFFFAOYSA-N
Mol Weight 532.59 g/mol
Molecular Formula C25H20N6O4S2
Exact Mass 532.098745 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9kZ93imda9L
Name 3,5-bis{[(1H-benzimidazol-2-ylsulfanyl)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/C25H20N6O4S2/c32-21(12-36-24-28-17-5-1-2-6-18(17)29-24)26-15-9-14(23(34)35)10-16(11-15)27-22(33)13-37-25-30-19-7-3-4-8-20(19)31-25/h1-11H,12-13H2,(H,26,32)(H,27,33)(H,28,29)(H,30,31)(H,34,35)
InChIKey IWCPNOANUQSFSI-UHFFFAOYSA-N
NMR Offset 15.4978
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5303
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/8149035; UBI_ID: UBI-005305
Temperature 315 °C