SpectraBase Spectrum ID |
5wj8qXsSyZq |
Name |
benzoic acid, 3-[[3-mercapto-5-(tetrahydro-2-furanyl)-4H-1,2,4-triazol-4-yl]methyl]- |
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/C14H15N3O3S/c18-13(19)10-4-1-3-9(7-10)8-17-12(15-16-14(17)21)11-5-2-6-20-11/h1,3-4,7,11H,2,5-6,8H2,(H,16,21)(H,18,19) |
InChIKey |
KXRKANZNSMFIDU-UHFFFAOYSA-N |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Origin |
1H_ASIOH_7529_6961 |
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/18277176; Labnumber: OBK-8540 |