| SpectraBase Compound ID | 7DpokSqaZDn |
|---|---|
| InChI | InChI=1S/C13H8N2O6/c16-13(9-1-3-10(4-2-9)14(17)18)21-12-7-5-11(6-8-12)15(19)20/h1-8H |
| InChIKey | MBSZPLPPLPIPMI-UHFFFAOYSA-N |
| Mol Weight | 288.22 g/mol |
| Molecular Formula | C13H8N2O6 |
| Exact Mass | 288.038236 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GmXjO0Tiu8J |
|---|---|
| Name | 4-Nitrobenzoic acid (4-nitrophenyl) ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H8N2O6 |
| InChI | InChI=1S/C13H8N2O6/c16-13(9-1-3-10(4-2-9)14(17)18)21-12-7-5-11(6-8-12)15(19)20/h1-8H |
| InChIKey | MBSZPLPPLPIPMI-UHFFFAOYSA-N |
| Molecular Weight | 288.215 g/mol |
| SMILES | c1(N(=O)=O)ccc(C(Oc2ccc(N(=O)=O)cc2)=O)cc1 |
| SPLASH | splash10-00kr-0900000000-0800df0c80352abcf115 |
| Source of Spectrum | OS-6-190-0 |
| Wiley ID | 1291364 |