| SpectraBase Compound ID | HDKaulxUaGK |
|---|---|
| InChI | InChI=1S/C17H13NO5/c1-9(19)18-11-5-6-14-13(8-11)15(21)16(22)17(23-14)10-3-2-4-12(20)7-10/h2-8,20,22H,1H3,(H,18,19) |
| InChIKey | IKTXUSMEUSGQMZ-UHFFFAOYSA-N |
| Mol Weight | 311.29 g/mol |
| Molecular Formula | C17H13NO5 |
| Exact Mass | 311.079373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G8VZRLngDVr |
|---|---|
| Name | 6-Acetamido-3,3'-dihydroxyflavone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.079372518 u |
| Formula | C17H13NO5 |
| InChI | InChI=1S/C17H13NO5/c1-9(19)18-11-5-6-14-13(8-11)15(21)16(22)17(23-14)10-3-2-4-12(20)7-10/h2-8,20,22H,1H3,(H,18,19) |
| InChIKey | IKTXUSMEUSGQMZ-UHFFFAOYSA-N |
| Molecular Weight | 311.293 g/mol |
| SMILES | OC1=CC=CC(C=2OC=3C=CC(=CC3C(C2O)=O)NC(C)=O)=C1 |