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

*Links on SpectraBase are not permalinks.

benzoic acid, 2-chloro-5-(3-cyclopropyl-5-mercapto-4H-1,2,4-triazol-4-yl)-

View entire compound with spectra: 1 NMR

benzoic acid, 2-chloro-5-(3-cyclopropyl-5-mercapto-4H-1,2,4-triazol-4-yl)-
SpectraBase Compound ID 7K5rfjVowLD
InChI InChI=1S/C12H10ClN3O2S/c13-9-4-3-7(5-8(9)11(17)18)16-10(6-1-2-6)14-15-12(16)19/h3-6H,1-2H2,(H,15,19)(H,17,18)
InChIKey IAKNVAOHAJMEPF-UHFFFAOYSA-N
Mol Weight 295.74 g/mol
Molecular Formula C12H10ClN3O2S
Exact Mass 295.018225 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 13ouoVjICo9
Name benzoic acid, 2-chloro-5-(3-cyclopropyl-5-mercapto-4H-1,2,4-triazol-4-yl)-
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/C12H10ClN3O2S/c13-9-4-3-7(5-8(9)11(17)18)16-10(6-1-2-6)14-15-12(16)19/h3-6H,1-2H2,(H,15,19)(H,17,18)
InChIKey IAKNVAOHAJMEPF-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6984
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: NMR/18277201; Labnumber: OBK-8665