| SpectraBase Spectrum ID |
JFKGjIk5cZs |
| Name |
1-(4-Nitrophenyl)-2-nitrobut-1-ene I |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
222.064056806 u |
| Formula |
C10H10N2O4 |
| InChI |
InChI=1S/C10H10N2O4/c1-2-9(11(13)14)7-8-3-5-10(6-4-8)12(15)16/h3-7H,2H2,1H3/b9-7- |
| InChIKey |
WFOBQJIBZWZLLZ-CLFYSBASSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
222.200 g/mol |
| Nominal Mass |
222 u |
| Quality |
990 |
| Retention Index |
1727 |
| SMILES |
C=1(C=CC(\C=C\([N+](=O)[O-])CC)=CC1)[N+](=O)[O-] |
| SPLASH |
splash10-004i-3900000000-4367d96eb341f5333c71 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-nitro-4-[(1Z)-2-nitrobut-1-en-1-yl]benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_003252 |
