| SpectraBase Compound ID | DIrTyp5UJG4 |
|---|---|
| InChI | InChI=1S/C9H10N2O4/c12-10(13)6-9(7-11(14)15)8-4-2-1-3-5-8/h1-5,9H,6-7H2 |
| InChIKey | SCTCOOGTIXVHQO-UHFFFAOYSA-N |
| Mol Weight | 210.19 g/mol |
| Molecular Formula | C9H10N2O4 |
| Exact Mass | 210.064057 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9ubkZTp95AO |
|---|---|
| Name | 1,3-Dinitropropan-2-ylbenzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H10N2O4 |
| InChI | InChI=1S/C9H10N2O4/c12-10(13)6-9(7-11(14)15)8-4-2-1-3-5-8/h1-5,9H,6-7H2 |
| InChIKey | SCTCOOGTIXVHQO-UHFFFAOYSA-N |
| Molecular Weight | 210.189 g/mol |
| SMILES | C(C(CN(=O)=O)c1ccccc1)N(=O)=O |
| SPLASH | splash10-014i-0900000000-0d22c2d8e6a13ef0dee7 |
| Source of Spectrum | D8-327-355-19 |
| Synonyms | [2-nitro-1-(nitromethyl)ethyl]benzene |
| Wiley ID | 1515231 |