| SpectraBase Spectrum ID |
G4FgK64ReQO |
| Name |
sodium 5-[(4-chloro-2-{2-[3-(trifluoromethyl)phenyl]acetyl}phenoxy)methyl]-1H-1,2,3,4-tetrazol-1-ide |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
419.037281049 u |
| Formula |
C16H10ClF3N5NaO2 |
| InChI |
InChI=1S/C16H11ClF3N5O2.Na/c17-10-4-5-13(27-8-14-22-24-25-23-14)12(7-10)15(26)21-11-3-1-2-9(6-11)16(18,19)20;/h1-7H,8H2,(H2,21,22,23,24,25,26);/q;+1/p-1 |
| InChIKey |
PXIPDOCTJNJTNS-UHFFFAOYSA-M |
| Molecular Weight |
419.727 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_2720 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12279866 |
![sodium 5-[(4-chloro-2-{2-[3-(trifluoromethyl)phenyl]acetyl}phenoxy)methyl]-1H-1,2,3,4-tetrazol-1-ide](/api/spectrum/G4FgK64ReQO/structure.png?h=300&w=458 "sodium 5-[(4-chloro-2-{2-[3-(trifluoromethyl)phenyl]acetyl}phenoxy)methyl]-1H-1,2,3,4-tetrazol-1-ide")
