| SpectraBase Compound ID | 7S0Oy3CXKJS |
|---|---|
| InChI | InChI=1S/C14H11NO4/c1-10-4-2-3-5-13(10)19-14(16)11-6-8-12(9-7-11)15(17)18/h2-9H,1H3 |
| InChIKey | JPSZFHPZVGXCEL-UHFFFAOYSA-N |
| Mol Weight | 257.24 g/mol |
| Molecular Formula | C14H11NO4 |
| Exact Mass | 257.068808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8ZQsyLaruyc |
|---|---|
| Name | p-Nitrobenzoic acid, o-tolyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.068807834 u |
| Formula | C14H11NO4 |
| InChI | InChI=1S/C14H11NO4/c1-10-4-2-3-5-13(10)19-14(16)11-6-8-12(9-7-11)15(17)18/h2-9H,1H3 |
| InChIKey | JPSZFHPZVGXCEL-UHFFFAOYSA-N |
| Molecular Weight | 257.245 g/mol |
| SMILES | N(=O)(=O)C1=CC=C(C=C1)C(OC=1C(=CC=CC1)C)=O |