| SpectraBase Compound ID | EwkCx4nLeVg |
|---|---|
| InChI | InChI=1S/C10H9NO4/c1-7(10(12)13)5-8-3-2-4-9(6-8)11(14)15/h2-6H,1H3,(H,12,13) |
| InChIKey | DMXDUJPYGUWROU-UHFFFAOYSA-N |
| Mol Weight | 207.18 g/mol |
| Molecular Formula | C10H9NO4 |
| Exact Mass | 207.053158 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JInmGpQOt1L |
|---|---|
| Name | alpha-Methyl-m-nitrocinnamic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.053157770 u |
| Formula | C10H9NO4 |
| InChI | InChI=1S/C10H9NO4/c1-7(10(12)13)5-8-3-2-4-9(6-8)11(14)15/h2-6H,1H3,(H,12,13) |
| InChIKey | DMXDUJPYGUWROU-UHFFFAOYSA-N |
| Molecular Weight | 207.185 g/mol |
| SMILES | OC(C(=CC1=CC=CC(=C1)N(=O)=O)C)=O |