| SpectraBase Compound ID | JzmwnHS1Rj2 |
|---|---|
| InChI | InChI=1S/C13H9NO4/c15-13(10-5-2-1-3-6-10)18-12-8-4-7-11(9-12)14(16)17/h1-9H |
| InChIKey | JWLQSDXEKWFFBU-UHFFFAOYSA-N |
| Mol Weight | 243.22 g/mol |
| Molecular Formula | C13H9NO4 |
| Exact Mass | 243.053158 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5PXbS13gTZ |
|---|---|
| Name | (3-nitrophenyl) benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H9NO4 |
| InChI | InChI=1S/C13H9NO4/c15-13(10-5-2-1-3-6-10)18-12-8-4-7-11(9-12)14(16)17/h1-9H |
| InChIKey | JWLQSDXEKWFFBU-UHFFFAOYSA-N |
| Molecular Weight | 243.218 g/mol |
| SMILES | c1(N(=O)=O)cc(OC(=O)c2ccccc2)ccc1 |
| SPLASH | splash10-004i-9100000000-fa8ba8f3c21f290221dc |
| Source of Spectrum | QB-21-54-2 |
| Synonyms | benzoic acid (3-nitrophenyl) ester |
| Wiley ID | 860525 |