| SpectraBase Spectrum ID |
5XLejfbpUye |
| Name |
1-(4-Isopropylphenyl)-2-nitroprop-1-ene |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
205.110278725 u |
| Formula |
C12H15NO2 |
| InChI |
InChI=1S/C12H15NO2/c1-9(2)12-6-4-11(5-7-12)8-10(3)13(14)15/h4-9H,1-3H3/b10-8- |
| InChIKey |
VLEXQFFBOYDGJH-NTMALXAHSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
205.257 g/mol |
| Nominal Mass |
205 u |
| Quality |
1000 |
| Retention Index |
1547 |
| SMILES |
C=1(\C=C\(N(=O)=O)C)C=CC(=CC1)C(C)C |
| SPLASH |
splash10-05ox-3900000000-9ec6e926cec4eaea7d66 |
| Sample Comments |
cis/trans isomerism uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Isopropyl-4-(2-nitro-1-propen-1-yl)benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024354 |
