| SpectraBase Compound ID | CdTYa8RfoPQ |
|---|---|
| InChI | InChI=1S/C19H12O4/c20-15-7-5-11(8-16(15)21)12-6-4-10-2-1-3-13-18(10)14(12)9-17(22)19(13)23/h1-9,20-22H |
| InChIKey | ZNAZPYKRTNDUEJ-UHFFFAOYSA-N |
| Mol Weight | 304.3 g/mol |
| Molecular Formula | C19H12O4 |
| Exact Mass | 304.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1IIAFxuODxt |
|---|---|
| Name | 4-(3,4-Dihydroxyphenyl)-2-hydroxy-1-phenalenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.073558862 u |
| Formula | C19H12O4 |
| InChI | InChI=1S/C19H12O4/c20-15-7-5-11(8-16(15)21)12-6-4-10-2-1-3-13-18(10)14(12)9-17(22)19(13)23/h1-9,20-22H |
| InChIKey | ZNAZPYKRTNDUEJ-UHFFFAOYSA-N |
| Molecular Weight | 304.301 g/mol |
| SMILES | C1=2C=C(O)C(C=3C2C(C=CC3)=CC=C1C=1C=C(O)C(=CC1)O)=O |