| SpectraBase Spectrum ID |
9DfFQhBy2Bv |
| Name |
piperazine, 1-[2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio]ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
492.155529666 u |
| Formula |
C22H23F3N6O2S |
| InChI |
InChI=1S/C22H23F3N6O2S/c1-28-20(16-5-3-2-4-6-16)26-27-21(28)34-14-13-29-9-11-30(12-10-29)18-8-7-17(22(23,24)25)15-19(18)31(32)33/h2-8,15H,9-14H2,1H3 |
| InChIKey |
JRIYZHCAGPBMDG-UHFFFAOYSA-N |
| Molecular Weight |
492.521 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6316 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9215773; Lab Info: LP; Lab Number: LP-2190147 |
![piperazine, 1-[2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio]ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-](/api/spectrum/9DfFQhBy2Bv/structure.png?h=300&w=458 "piperazine, 1-[2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio]ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-")
