| SpectraBase Compound ID | KSFmEldB3iV |
|---|---|
| InChI | InChI=1S/C7H15NO2/c1-6(2)5-7(3,4)8(9)10/h6H,5H2,1-4H3 |
| InChIKey | JOTFJIBCIJGTAS-UHFFFAOYSA-N |
| Mol Weight | 145.2 g/mol |
| Molecular Formula | C7H15NO2 |
| Exact Mass | 145.110279 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B2xayKrZWz2 |
|---|---|
| Name | Pentane, 2,4-dimethyl-2-nitro- |
| CAS Registry Number | 597-45-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H15NO2 |
| InChI | InChI=1S/C7H15NO2/c1-6(2)5-7(3,4)8(9)10/h6H,5H2,1-4H3 |
| InChIKey | JOTFJIBCIJGTAS-UHFFFAOYSA-N |
| Molecular Weight | 145.202 g/mol |
| SMILES | C(CC(C)C)(N(=O)=O)(C)C |
| SPLASH | splash10-0a4l-9000000000-fcaf77a5ad73a95226b1 |
| Source of Spectrum | PG-1982-109-0 |
| Synonyms | 2,4-Dimethyl-2-nitropentane |
| Wiley ID | 1143362 |