| SpectraBase Spectrum ID |
Ivr6riOYwBt |
| Name |
Trinitrodiphenylamine I |
| Classification |
Gunshot residue |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
304.044383988 u |
| Formula |
C12H8N4O6 |
| InChI |
InChI=1S/C12H8N4O6/c17-14(18)9-3-1-8(2-4-9)13-11-6-5-10(15(19)20)7-12(11)16(21)22/h1-7,13H |
| InChIKey |
MQZAHSOZWFOSGD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
304.218 g/mol |
| Nominal Mass |
304 u |
| Quality |
882 |
| Retention Index |
2792 |
| SMILES |
C=1(C(=CC(=CC1)[N+](=O)[O-])[N+](=O)[O-])NC=1C=CC(=CC1)[N+](=O)[O-] |
| SPLASH |
splash10-0pbi-5940000000-c401092e688949ee801a |
| Sample Comments |
Nitro position uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,4-dinitro-N-(4-nitrophenyl)aniline |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006002 |
