| SpectraBase Compound ID | LncqVtg9FRw |
|---|---|
| InChI | InChI=1S/C8H6N2O5/c11-8(5-9(12)13)6-2-1-3-7(4-6)10(14)15/h1-4H,5H2 |
| InChIKey | UJLJTTKZVUPJBQ-UHFFFAOYSA-N |
| Mol Weight | 210.14 g/mol |
| Molecular Formula | C8H6N2O5 |
| Exact Mass | 210.027671 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EaskiMWAmJ4 |
|---|---|
| Name | 2-nitro-1-(3-nitrophenyl)ethanone |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6N2O5 |
| InChI | InChI=1S/C8H6N2O5/c11-8(5-9(12)13)6-2-1-3-7(4-6)10(14)15/h1-4H,5H2 |
| InChIKey | UJLJTTKZVUPJBQ-UHFFFAOYSA-N |
| Molecular Weight | 210.145 g/mol |
| SMILES | c1(N(=O)=O)cc(C(CN(=O)=O)=O)ccc1 |
| SPLASH | splash10-0udi-0910000000-e964c9cf82105de07161 |
| Source of Spectrum | SO-1978-478-3 |
| Wiley ID | 1537084 |