| SpectraBase Spectrum ID |
7fi4rHFDeWq |
| Name |
2-chloro-5-(5-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-tetraazol-1-yl)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/C16H11ClFN5O3S/c17-13-6-5-11(7-12(13)15(25)26)23-16(20-21-22-23)27-8-14(24)19-10-3-1-9(18)2-4-10/h1-7H,8H2,(H,19,24)(H,25,26) |
| InChIKey |
YFQGAYIXPZNNIE-UHFFFAOYSA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_22313 |
| 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: D58587; Labnumber: SPLUK-0898; SBI_ID: SBI-022317 |
| Temperature |
318 °C |
![2-chloro-5-(5-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-tetraazol-1-yl)benzoic acid](/api/spectrum/7fi4rHFDeWq/structure.png?h=300&w=458 "2-chloro-5-(5-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-tetraazol-1-yl)benzoic acid")
