![1,3-Dinitrobicyclo[1.1.1]pentane](/api/spectrum/FJHKSxlG2oA/structure.png?h=300&w=458 "1,3-Dinitrobicyclo[1.1.1]pentane")
| SpectraBase Compound ID | Ic4DecftkTX |
|---|---|
| InChI | InChI=1S/C5H6N2O4/c8-6(9)4-1-5(2-4,3-4)7(10)11/h1-3H2 |
| InChIKey | STBMAGHJTCWFGO-UHFFFAOYSA-N |
| Mol Weight | 158.11 g/mol |
| Molecular Formula | C5H6N2O4 |
| Exact Mass | 158.032757 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FJHKSxlG2oA |
|---|---|
| Name | 1,3-Dinitrobicyclo[1.1.1]pentane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H6N2O4 |
| InChI | InChI=1S/C5H6N2O4/c8-6(9)4-1-5(2-4,3-4)7(10)11/h1-3H2 |
| InChIKey | STBMAGHJTCWFGO-UHFFFAOYSA-N |
| Molecular Weight | 158.113 g/mol |
| SMILES | C12(CC(C2)(C1)N(=O)=O)N(=O)=O |
| SPLASH | splash10-014r-9000000000-5e50bc5efefb5a1ca513 |
| Source of Spectrum | J-58-1376-0 |
| Wiley ID | 1154910 |