| SpectraBase Compound ID | 3Scs1nmjD7Z |
|---|---|
| InChI | InChI=1S/C13H8N2O5/c16-13(9-4-3-5-10(8-9)14(17)18)11-6-1-2-7-12(11)15(19)20/h1-8H |
| InChIKey | PBJHVHYQMJRIBN-UHFFFAOYSA-N |
| Mol Weight | 272.22 g/mol |
| Molecular Formula | C13H8N2O5 |
| Exact Mass | 272.043321 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JEMxOvCHmpB |
|---|---|
| Name | (2-nitrophenyl)-(3-nitrophenyl)methanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H8N2O5 |
| InChI | InChI=1S/C13H8N2O5/c16-13(9-4-3-5-10(8-9)14(17)18)11-6-1-2-7-12(11)15(19)20/h1-8H |
| InChIKey | PBJHVHYQMJRIBN-UHFFFAOYSA-N |
| Molecular Weight | 272.216 g/mol |
| SMILES | c1(N(=O)=O)c(C(c2cc(N(=O)=O)ccc2)=O)cccc1 |
| SPLASH | splash10-0udi-2900000000-c9ab4f291f2e88f23a23 |
| Source of Spectrum | KC-0-907-4 |
| Wiley ID | 781099 |