| SpectraBase Compound ID | 5Aqz5MORpbp |
|---|---|
| InChI | InChI=1S/C15H11NO4/c17-14(11-4-2-1-3-5-11)10-15(18)12-6-8-13(9-7-12)16(19)20/h1-9H,10H2 |
| InChIKey | MIVNAJMLVLKIJI-UHFFFAOYSA-N |
| Mol Weight | 269.26 g/mol |
| Molecular Formula | C15H11NO4 |
| Exact Mass | 269.068808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J7R4IMiS25F |
|---|---|
| Name | 1,3-Propanedione, 1-(p-nitrophenyl)-3-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.068807834 u |
| Formula | C15H11NO4 |
| InChI | InChI=1S/C15H11NO4/c17-14(11-4-2-1-3-5-11)10-15(18)12-6-8-13(9-7-12)16(19)20/h1-9H,10H2 |
| InChIKey | MIVNAJMLVLKIJI-UHFFFAOYSA-N |
| SMILES | C1=CC=C(C=C1)C(CC(C=1C=CC(N(=O)=O)=CC1)=O)=O |