| SpectraBase Spectrum ID |
EaEHdglaJT3 |
| Name |
2,6-Diphenyl-4H-pyran-4-one, picrate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
477.080829066 u |
| Formula |
C23H15N3O9 |
| InChI |
InChI=1S/C17H12O2.C6H3N3O7/c18-15-11-16(13-7-3-1-4-8-13)19-17(12-15)14-9-5-2-6-10-14;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-12H;1-2,10H |
| InChIKey |
CCUXBEQXVVTDGR-UHFFFAOYSA-N |
| Molecular Weight |
477.385 g/mol |
| SMILES |
N(=O)(=O)C=1C=C(C=C(C1O)N(=O)=O)N(=O)=O.C=1C(=CC=CC1)C=1OC(=CC(C1)=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) |
0.873579 |
