| SpectraBase Compound ID | 2ax5yfWMvwP |
|---|---|
| InChI | InChI=1S/C8H5N3O8/c12-9(13)4-3-5-8(19-2-1-18-5)7(11(16)17)6(4)10(14)15/h3H,1-2H2 |
| InChIKey | JWGHEORPZNJONK-UHFFFAOYSA-N |
| Mol Weight | 271.14 g/mol |
| Molecular Formula | C8H5N3O8 |
| Exact Mass | 271.007664 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GhPYjCCniTN |
|---|---|
| Name | 5,6,7-TRINITRO-1,4-BENZODIOXANE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H5N3O8 |
| InChI | InChI=1S/C8H5N3O8/c12-9(13)4-3-5-8(19-2-1-18-5)7(11(16)17)6(4)10(14)15/h3H,1-2H2 |
| InChIKey | JWGHEORPZNJONK-UHFFFAOYSA-N |
| Molecular Weight | 271.0075 |
| SMILES | c1(N(=O)=O)c(N(=O)=O)c2OCCOc2cc1N(=O)=O |
| SPLASH | splash10-016r-9000000000-71a8601ece577e48e7ff |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |