| SpectraBase Compound ID | EgKiOLqtnvh |
|---|---|
| InChI | InChI=1S/C10H11NO5/c1-7(12)16-6-8-3-4-10(15-2)9(5-8)11(13)14/h3-5H,6H2,1-2H3 |
| InChIKey | GQZJPLTVIHEURG-UHFFFAOYSA-N |
| Mol Weight | 225.2 g/mol |
| Molecular Formula | C10H11NO5 |
| Exact Mass | 225.063722 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HVPo3wOm1Z6 |
|---|---|
| Name | 4-Methoxy-3-nitrobenzyl alcohol, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.063722453 u |
| Formula | C10H11NO5 |
| InChI | InChI=1S/C10H11NO5/c1-7(12)16-6-8-3-4-10(15-2)9(5-8)11(13)14/h3-5H,6H2,1-2H3 |
| InChIKey | GQZJPLTVIHEURG-UHFFFAOYSA-N |
| Molecular Weight | 225.200 g/mol |
| SMILES | C1(=CC(=C(C=C1)OC)N(=O)=O)COC(C)=O |