| SpectraBase Compound ID | 3vHnswAcfa2 |
|---|---|
| InChI | InChI=1S/C13H8N2O6/c16-13(9-3-1-4-10(7-9)14(17)18)21-12-6-2-5-11(8-12)15(19)20/h1-8H |
| InChIKey | NWVBVWLXOAXKNI-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 | G0ePeb2BtT6 |
|---|---|
| Name | 3-Nitrobenzoic acid (3-nitrophenyl) ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H8N2O6 |
| InChI | InChI=1S/C13H8N2O6/c16-13(9-3-1-4-10(7-9)14(17)18)21-12-6-2-5-11(8-12)15(19)20/h1-8H |
| InChIKey | NWVBVWLXOAXKNI-UHFFFAOYSA-N |
| Molecular Weight | 288.215 g/mol |
| SMILES | c1(N(=O)=O)cc(OC(c2cc(N(=O)=O)ccc2)=O)ccc1 |
| SPLASH | splash10-000i-0890000000-e2941f873196b4623e41 |
| Source of Spectrum | OS-6-165-0 |
| Wiley ID | 1291363 |