| SpectraBase Spectrum ID |
5WJe3PRT2u0 |
| Name |
2-Methyl-3-nitroaniline |
| CAS Registry Number |
603-83-8 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
152.058577504 u |
| Formula |
C7H8N2O2 |
| InChI |
InChI=1S/C7H8N2O2/c1-5-6(8)3-2-4-7(5)9(10)11/h2-4H,8H2,1H3 |
| InChIKey |
HFCFJYRLBAANKN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
152.153 g/mol |
| Nominal Mass |
152 u |
| Quality |
943 |
| Retention Index |
1233 |
| SMILES |
NC1=C(C([N+](=O)[O-])=CC=C1)C |
| SPLASH |
splash10-0fb9-9600000000-72b39b91da97fa2f6fcd |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-Methyl-3-nitro-aniline |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002305 |
