| SpectraBase Compound ID | IPMCICMtizp |
|---|---|
| InChI | InChI=1S/C13H11NO5/c1-18-9-2-4-10(5-3-9)19-11-6-7-12(14(16)17)13(15)8-11/h2-8,15H,1H3 |
| InChIKey | AZZZROCIEBITKJ-UHFFFAOYSA-N |
| Mol Weight | 261.23 g/mol |
| Molecular Formula | C13H11NO5 |
| Exact Mass | 261.063722 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HVhVCJJQ8aM |
|---|---|
| Name | Benzene, 1-nitro-2-hydroxy-4-(p-methoxyphenoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.063722453 u |
| Formula | C13H11NO5 |
| InChI | InChI=1S/C13H11NO5/c1-18-9-2-4-10(5-3-9)19-11-6-7-12(14(16)17)13(15)8-11/h2-8,15H,1H3 |
| InChIKey | AZZZROCIEBITKJ-UHFFFAOYSA-N |
| Molecular Weight | 261.233 g/mol |
| SMILES | C1(O)=CC(=CC=C1N(=O)=O)OC=1C=CC(OC)=CC1 |