| SpectraBase Spectrum ID |
AEMXoh0cvba |
| Name |
ethanone, 1-[5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(1,1-dimethylethyl)-4,5-dihydro-1-phenyl-1H-1,2,4-triazol-3-yl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
461.187004852 u |
| Formula |
C27H28ClN3O2 |
| InChI |
InChI=1S/C27H28ClN3O2/c1-19(32)25-29-31(23-10-6-5-7-11-23)26(30(25)27(2,3)4)21-9-8-12-24(17-21)33-18-20-13-15-22(28)16-14-20/h5-17,26H,18H2,1-4H3 |
| InChIKey |
BVXIVSYOKMOYDK-UHFFFAOYSA-N |
| Molecular Weight |
461.993 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2184 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8117466; Lab Info: LP; Lab Number: LP-3900068 |
| Temperature |
29.85 °C |
![ethanone, 1-[5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(1,1-dimethylethyl)-4,5-dihydro-1-phenyl-1H-1,2,4-triazol-3-yl]-](/api/spectrum/AEMXoh0cvba/structure.png?h=300&w=458 "ethanone, 1-[5-[3-[(4-chlorophenyl)methoxy]phenyl]-4-(1,1-dimethylethyl)-4,5-dihydro-1-phenyl-1H-1,2,4-triazol-3-yl]-")
