| SpectraBase Spectrum ID |
HorN3iyhnDG |
| Name |
5-Methyl-2-(4'-(trifluoromethyl)-[1,1'-biphenyl]-2-yl)-2,4-dihydro-3H-pyrazol-3-one |
| Appearance |
Off-white solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.097997535 u |
| Formula |
C17H13F3N2O |
| InChI |
InChI=1S/C17H13F3N2O/c1-11-10-16(23)22(21-11)15-5-3-2-4-14(15)12-6-8-13(9-7-12)17(18,19)20/h2-9H,10H2,1H3 |
| InChIKey |
DJYNOJIXYRXXKU-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201710053 |
| Molecular Weight |
318.299 g/mol |
| Quality |
30 |
| Reported Formula |
C17H13F3N2O |
| SMILES |
CC=1CC(N(N1)C1=C(C=CC=C1)C1=CC=C(C=C1)C(F)(F)F)=O |
| SPLASH |
splash10-0udi-0294000000-5ae41db1f716bf52ea3f |
| Source of Spectrum |
ACI-56-SM16-5e (DOI: 10.1002/anie.201710053) |
| Thin-Layer Chromatography |
0.35 (hexanes/EtOAc, 1:1) |
| Wiley ID |
1896767 |
![5-Methyl-2-(4'-(trifluoromethyl)-[1,1'-biphenyl]-2-yl)-2,4-dihydro-3H-pyrazol-3-one](/api/spectrum/HorN3iyhnDG/structure.png?h=300&w=458 "5-Methyl-2-(4'-(trifluoromethyl)-[1,1'-biphenyl]-2-yl)-2,4-dihydro-3H-pyrazol-3-one")
