| SpectraBase Spectrum ID |
4XFSBg4gVs |
| Name |
(E)-2,4,6-Trimethylphenyl-2-nitropropene |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
205.110278725 u |
| Formula |
C12H15NO2 |
| InChI |
InChI=1S/C12H15NO2/c1-8-5-9(2)12(10(3)6-8)7-11(4)13(14)15/h5-7H,1-4H3/b11-7+ |
| InChIKey |
CILKZWLODIJOFN-YRNVUSSQSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
205.257 g/mol |
| Nominal Mass |
205 u |
| Quality |
974 |
| Retention Index |
1601 |
| SMILES |
C1(=C(C=C(C=C1C)C)C)\C=C/([N+](=O)[O-])C |
| SPLASH |
splash10-054o-2900000000-650e5cd9b6c96ed9f8bd |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,3,5-trimethyl-2-((1E)-2-nitroprop-1-en-1-yl)benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005790 |
