| SpectraBase Spectrum ID |
9q7YVN8XRyK |
| Name |
ethyl 4-[({[1-(2-fluorophenyl)-1H-tetraazol-5-yl]sulfanyl}acetyl)amino]benzoate |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
401.095788729 u |
| Formula |
C18H16FN5O3S |
| InChI |
InChI=1S/C18H16FN5O3S/c1-2-27-17(26)12-7-9-13(10-8-12)20-16(25)11-28-18-21-22-23-24(18)15-6-4-3-5-14(15)19/h3-10H,2,11H2,1H3,(H,20,25) |
| InChIKey |
VJWPFPQZUDXYIL-UHFFFAOYSA-N |
| Molecular Weight |
401.416 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_8752 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13228028 |
![ethyl 4-[({[1-(2-fluorophenyl)-1H-tetraazol-5-yl]sulfanyl}acetyl)amino]benzoate](/api/spectrum/9q7YVN8XRyK/structure.png?h=300&w=458 "ethyl 4-[({[1-(2-fluorophenyl)-1H-tetraazol-5-yl]sulfanyl}acetyl)amino]benzoate")
