| SpectraBase Spectrum ID |
Ca9blVSNPOx |
| Name |
1-Nitro-2-[2-nitroethenyl]benzene |
| CAS Registry Number |
3156-39-6 |
| Classification |
Designer drug precursor |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| 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)6-5-7-3-1-2-4-8(7)10(13)14/h1-6H/b6-5+ |
| InChIKey |
INIQBBVYBCGEIX-AATRIKPKSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
194.146 g/mol |
| Nominal Mass |
194 u |
| Quality |
988 |
| Retention Index |
1775 |
| SMILES |
C=1(C([N+](=O)[O-])=CC=CC1)\C=C\[N+](=O)[O-] |
| SPLASH |
splash10-0fto-9100000000-23e801ba10aa3b7f35ab |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Nitro-2-[(E)-2-nitroethenyl]benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005245 |
![1-Nitro-2-[2-nitroethenyl]benzene](/api/spectrum/Ca9blVSNPOx/structure.png?h=300&w=458 "1-Nitro-2-[2-nitroethenyl]benzene")
