| SpectraBase Spectrum ID |
2pTiAOYxmMa |
| Name |
(E)-1-(4-Methylphenyl)-2-nitrobut-1-ene |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
191.094628661 u |
| Formula |
C11H13NO2 |
| InChI |
InChI=1S/C11H13NO2/c1-3-11(12(13)14)8-10-6-4-9(2)5-7-10/h4-8H,3H2,1-2H3/b11-8+ |
| InChIKey |
YUDIMQCLFNBLGC-DHZHZOJOSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
191.230 g/mol |
| Nominal Mass |
191 u |
| Quality |
977 |
| Retention Index |
1577 |
| SMILES |
C=1(\C=C/([N+](=O)[O-])CC)C=CC(=CC1)C |
| SPLASH |
splash10-056r-5900000000-e4c6fd7841cca2ad390b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-methyl-4-((1E)-2-nitrobut-1-en-1-yl)benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005364 |
