| SpectraBase Compound ID | 3OTp8BZRv0n |
|---|---|
| InChI | InChI=1S/C15H13NO6/c1-21-9-7-12(17)14(13(8-9)22-2)15(18)10-5-3-4-6-11(10)16(19)20/h3-8,17H,1-2H3 |
| InChIKey | OOCRWZDHWICGJG-UHFFFAOYSA-N |
| Mol Weight | 303.27 g/mol |
| Molecular Formula | C15H13NO6 |
| Exact Mass | 303.074287 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JPviWcOYlGM |
|---|---|
| Name | Methanone, (2-hydroxy-4,6-dimethoxyphenyl)(2-nitrophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.074287137 u |
| Formula | C15H13NO6 |
| InChI | InChI=1S/C15H13NO6/c1-21-9-7-12(17)14(13(8-9)22-2)15(18)10-5-3-4-6-11(10)16(19)20/h3-8,17H,1-2H3 |
| InChIKey | OOCRWZDHWICGJG-UHFFFAOYSA-N |
| Molecular Weight | 303.270 g/mol |
| SMILES | C=1(C(C=2C(N(=O)=O)=CC=CC2)=O)C(=CC(=CC1OC)OC)O |