![3H-Pyrazol-3-one, 4-[[4-(dimethylamino)phenyl]imino]-2,4-dihydro-5-methyl-2-phenyl-](/api/spectrum/94jaJiCuKLR/structure.png?h=300&w=458 "3H-Pyrazol-3-one, 4-[[4-(dimethylamino)phenyl]imino]-2,4-dihydro-5-methyl-2-phenyl-")
| SpectraBase Compound ID | 7ERBkhR8PkL |
|---|---|
| InChI | InChI=1S/C18H18N4O/c1-13-17(19-14-9-11-15(12-10-14)21(2)3)18(23)22(20-13)16-7-5-4-6-8-16/h4-12H,1-3H3/b19-17+ |
| InChIKey | ASAZWLJLSPILII-HTXNQAPBSA-N |
| Mol Weight | 306.37 g/mol |
| Molecular Formula | C18H18N4O |
| Exact Mass | 306.148061 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 94jaJiCuKLR |
|---|---|
| Name | 3H-Pyrazol-3-one, 4-[[4-(dimethylamino)phenyl]imino]-2,4-dihydro-5-methyl-2-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.148061215 u |
| Formula | C18H18N4O |
| InChI | InChI=1S/C18H18N4O/c1-13-17(19-14-9-11-15(12-10-14)21(2)3)18(23)22(20-13)16-7-5-4-6-8-16/h4-12H,1-3H3/b19-17+ |
| InChIKey | ASAZWLJLSPILII-HTXNQAPBSA-N |
| SMILES | C1(\C(C(=NN1C1=CC=CC=C1)C)=N\C1=CC=C(C=C1)N(C)C)=O |