| SpectraBase Spectrum ID |
AzWupj5IUAy |
| Name |
1-(4-Methylphenyl)-2-nitroprop-1-ene |
| CAS Registry Number |
29816-55-5 |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
177.078978596 u |
| Formula |
C10H11NO2 |
| InChI |
InChI=1S/C10H11NO2/c1-8-3-5-10(6-4-8)7-9(2)11(12)13/h3-7H,1-2H3/b9-7- |
| InChIKey |
JEKFDNFWPBWEKO-CLFYSBASSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
177.203 g/mol |
| Nominal Mass |
177 u |
| Quality |
992 |
| Retention Index |
1558 |
| SMILES |
C=1(\C=C\([N+](=O)[O-])C)C=CC(=CC1)C |
| SPLASH |
splash10-014i-9800000000-db1942af942dd0095a6e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-Methyl-beta-methyl-beta-nitrostyrene
1-Methyl-4-(2-nitro-1-propen-1-yl)benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005363 |
![1-Methyl-4-[(1Z)-2-nitro-1-propenyl]benzene](/api/spectrum/AzWupj5IUAy/structure.png?h=300&w=458 "1-Methyl-4-[(1Z)-2-nitro-1-propenyl]benzene")
