| SpectraBase Spectrum ID |
GgGBimcnzXf |
| Name |
4H-1,2,4-triazole, 3-[[(6-chloro-1,3-benzodioxol-5-yl)methyl]thio]-5-(3-fluorophenyl)-4-phenyl- |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.055753770 u |
| Formula |
C22H15ClFN3O2S |
| InChI |
InChI=1S/C22H15ClFN3O2S/c23-18-11-20-19(28-13-29-20)10-15(18)12-30-22-26-25-21(14-5-4-6-16(24)9-14)27(22)17-7-2-1-3-8-17/h1-11H,12-13H2 |
| InChIKey |
PINLUNBGGIAWDA-UHFFFAOYSA-N |
| Molecular Weight |
439.892 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_16128 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11210067; Lab Info: SAD; Lab Number: 82 |
![4H-1,2,4-triazole, 3-[[(6-chloro-1,3-benzodioxol-5-yl)methyl]thio]-5-(3-fluorophenyl)-4-phenyl-](/api/spectrum/GgGBimcnzXf/structure.png?h=300&w=458 "4H-1,2,4-triazole, 3-[[(6-chloro-1,3-benzodioxol-5-yl)methyl]thio]-5-(3-fluorophenyl)-4-phenyl-")
