| SpectraBase Spectrum ID |
B4EnInUpPEG |
| Name |
3-Methyl-beta-nitrostyrene |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
163.063328532 u |
| Formula |
C9H9NO2 |
| InChI |
InChI=1S/C9H9NO2/c1-8-3-2-4-9(7-8)5-6-10(11)12/h2-7H,1H3/b6-5- |
| InChIKey |
YYYVODQGPSIUNS-WAYWQWQTSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
163.176 g/mol |
| Nominal Mass |
163 u |
| Quality |
953 |
| Retention Index |
1250 |
| SMILES |
C1(=CC(=CC=C1)C)\C=C/[N+](=O)[O-] |
| SPLASH |
splash10-014i-9800000000-2bf32d248a689dae610f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-methyl-3-((Z)-2-nitroethenyl)benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002097 |
