| SpectraBase Spectrum ID |
1CcZ6aNbcxb |
| Name |
benzoic acid, 5-[3-(4-bromophenyl)-5-mercapto-4H-1,2,4-triazol-4-yl]-2-chloro- |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C15H9BrClN3O2S/c16-9-3-1-8(2-4-9)13-18-19-15(23)20(13)10-5-6-12(17)11(7-10)14(21)22/h1-7H,(H,19,23)(H,21,22) |
| InChIKey |
PMDPORHDPISPPO-UHFFFAOYSA-N |
| NMR Offset |
15.449 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_11628_305 |
| 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: F03909; Labnumber: NNOBK-8321 |
| Temperature |
308 °C |
![benzoic acid, 5-[3-(4-bromophenyl)-5-mercapto-4H-1,2,4-triazol-4-yl]-2-chloro-](/api/spectrum/1CcZ6aNbcxb/structure.png?h=300&w=458 "benzoic acid, 5-[3-(4-bromophenyl)-5-mercapto-4H-1,2,4-triazol-4-yl]-2-chloro-")
