| SpectraBase Spectrum ID |
A5LPtktWYKA |
| Name |
benzoic acid, 3-[[3-[(3,5-difluorophenyl)methyl]-5-mercapto-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/C17H13F2N3O2S/c18-13-5-11(6-14(19)8-13)7-15-20-21-17(25)22(15)9-10-2-1-3-12(4-10)16(23)24/h1-6,8H,7,9H2,(H,21,25)(H,23,24) |
| InChIKey |
RAKZCYOADMTYAJ-UHFFFAOYSA-N |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Origin |
1H_ASIOH_7529_5822 |
| 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/18217295 |
![benzoic acid, 3-[[3-[(3,5-difluorophenyl)methyl]-5-mercapto-4H-1,2,4-triazol-4-yl]methyl]-](/api/spectrum/A5LPtktWYKA/structure.png?h=300&w=458 "benzoic acid, 3-[[3-[(3,5-difluorophenyl)methyl]-5-mercapto-4H-1,2,4-triazol-4-yl]methyl]-")
