| SpectraBase Spectrum ID |
JFmmyX8APMu |
| Name |
1-Nitro-4-[2-nitroethenyl]benzene |
| CAS Registry Number |
3156-41-0 |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
194.032756677 u |
| Formula |
C8H6N2O4 |
| InChI |
InChI=1S/C8H6N2O4/c11-9(12)6-5-7-1-3-8(4-2-7)10(13)14/h1-6H/b6-5- |
| InChIKey |
HABXLWPUIWFTNM-WAYWQWQTSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
194.146 g/mol |
| Nominal Mass |
194 u |
| Quality |
972 |
| Retention Index |
1821 |
| SMILES |
C=1(C=CC(=CC1)\C=C/[N+](=O)[O-])[N+](=O)[O-] |
| SPLASH |
splash10-0ug4-9700000000-934df5a689ec536eb3af |
| Sample Comments |
cis/trans isomerism uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Nitro-4-(2-nitrovinyl)benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024314 |
![1-Nitro-4-[2-nitroethenyl]benzene](/api/spectrum/JFmmyX8APMu/structure.png?h=300&w=458 "1-Nitro-4-[2-nitroethenyl]benzene")
