| SpectraBase Spectrum ID |
HMGtuPWpkoF |
| Name |
4H-1,2,4-triazole, 4-cyclohexyl-3-[4-(1,1-dimethylethyl)phenyl]-5-[[[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]thio]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
521.212396455 u |
| Formula |
C27H31F4N3OS |
| InChI |
InChI=1S/C27H31F4N3OS/c1-26(2,3)20-13-11-19(12-14-20)23-32-33-25(34(23)21-7-5-4-6-8-21)36-17-18-9-15-22(16-10-18)35-27(30,31)24(28)29/h9-16,21,24H,4-8,17H2,1-3H3 |
| InChIKey |
PRUIOWUHAIZJNE-UHFFFAOYSA-N |
| Molecular Weight |
521.619 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11605 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10271159; Lab Info: LP; Lab Number: LP-2100879 |
![4H-1,2,4-triazole, 4-cyclohexyl-3-[4-(1,1-dimethylethyl)phenyl]-5-[[[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]thio]-](/api/spectrum/HMGtuPWpkoF/structure.png?h=300&w=458 "4H-1,2,4-triazole, 4-cyclohexyl-3-[4-(1,1-dimethylethyl)phenyl]-5-[[[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]thio]-")
