| SpectraBase Spectrum ID |
DooG2S9THjk |
| Name |
2-Methyl-5-nitroaniline |
| CAS Registry Number |
99-55-8 |
| 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/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,8H2,1H3 |
| InChIKey |
DSBIJCMXAIKKKI-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
152.153 g/mol |
| Nominal Mass |
152 u |
| Quality |
942 |
| Retention Index |
1233 |
| SMILES |
NC1=C(C=CC(=C1)[N+](=O)[O-])C |
| SPLASH |
splash10-0fb9-9500000000-7d547f43453e99fa38eb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-Methyl-5-nitro-aniline |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002306 |
