| SpectraBase Spectrum ID |
KAw5XgDfBkK |
| Name |
3-Methyl-4-{{[m-(trifluoromethyl)benzyl]amino}methylene}-2-pyrazolin-5-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
283.093246506 u |
| Formula |
C13H12F3N3O |
| InChI |
InChI=1S/C13H12F3N3O/c1-8-11(12(20)19-18-8)7-17-6-9-3-2-4-10(5-9)13(14,15)16/h2-5,7,17H,6H2,1H3,(H,19,20) |
| InChIKey |
XELUCNDNGUBNLQ-UHFFFAOYSA-N |
| Molecular Weight |
283.254 g/mol |
| SMILES |
N(CC1=CC=CC(=C1)C(F)(F)F)C=C1C(=NNC1=O)C |
![3-Methyl-4-{{[m-(trifluoromethyl)benzyl]amino}methylene}-2-pyrazolin-5-one](/api/spectrum/KAw5XgDfBkK/structure.png?h=300&w=458 "3-Methyl-4-{{[m-(trifluoromethyl)benzyl]amino}methylene}-2-pyrazolin-5-one")
