| SpectraBase Spectrum ID |
8GwDVPyVIO0 |
| Name |
Tetranitrodiphenylamine I |
| Classification |
Gunshot residue |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
349.029462197 u |
| Formula |
C12H7N5O8 |
| InChI |
InChI=1S/C12H7N5O8/c18-14(19)7-1-3-9(11(5-7)16(22)23)13-10-4-2-8(15(20)21)6-12(10)17(24)25/h1-6,13H |
| InChIKey |
UHWJMXASZSKFEO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
349.215 g/mol |
| Nominal Mass |
349 u |
| Quality |
960 |
| Retention Index |
3339 |
| SMILES |
C1(NC=2C(=CC(=CC2)[N+](=O)[O-])[N+](=O)[O-])=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-] |
| SPLASH |
splash10-0udi-1891000000-ef1d47ce399b432b0cbd |
| Sample Comments |
Nitro position uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(2,4-dinitrophenyl)-2,4-dinitroaniline |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006005 |
