| SpectraBase Spectrum ID |
5rBdtzA1gnt |
| Name |
1H-Pyrazol-5-one, 4-[(3-bromophenyl)methylidene]-3-methyl-1-phenyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.021126046 u |
| Formula |
C17H13BrN2O |
| InChI |
InChI=1S/C17H13BrN2O/c1-12-16(11-13-6-5-7-14(18)10-13)17(21)20(19-12)15-8-3-2-4-9-15/h2-11H,1H3/b16-11- |
| InChIKey |
GHFRAENFULXQGA-WJDWOHSUSA-N |
| Molecular Weight |
341.208 g/mol |
| SMILES |
C1(\C(C(=NN1C=1C=CC=CC1)C)=C/C1=CC(Br)=CC=C1)=O |
![1H-Pyrazol-5-one, 4-[(3-bromophenyl)methylidene]-3-methyl-1-phenyl-](/api/spectrum/5rBdtzA1gnt/structure.png?h=300&w=458 "1H-Pyrazol-5-one, 4-[(3-bromophenyl)methylidene]-3-methyl-1-phenyl-")
