| SpectraBase Spectrum ID |
alBt0MJrk |
| Name |
2,3-Dinitrotoluene |
| CAS Registry Number |
602-01-7 |
| Classification |
Explosive |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
182.032756677 u |
| Formula |
C7H6N2O4 |
| InChI |
InChI=1S/C7H6N2O4/c1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2-4H,1H3 |
| InChIKey |
DYSXLQBUUOPLBB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
182.135 g/mol |
| Nominal Mass |
182 u |
| Quality |
947 |
| Retention Index |
1439 |
| SMILES |
C=1(C([N+](=O)[O-])=CC=CC1C)[N+](=O)[O-] |
| SPLASH |
splash10-014r-9700000000-1b25aea42517364e0c1f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-methyl-2,3-dinitrobenzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001184 |
