SpectraBase Spectrum ID |
8GtOk2xpAZ6 |
Name |
1-(5-Bromo-3-pyridyl)-2-nitroprop-1-ene |
Classification |
Designer drug precursor |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
241.969090471 u |
Formula |
C8H7BrN2O2 |
InChI |
InChI=1S/C8H7BrN2O2/c1-6(11(12)13)2-7-3-8(9)5-10-4-7/h2-5H,1H3/b6-2- |
InChIKey |
YITSSUAOHVCSHI-KXFIGUGUSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
243.060 g/mol |
Nominal Mass |
242 u |
Quality |
920 |
Retention Index |
1832 |
SMILES |
C=1(\C=C\([N+](=O)[O-])C)C=C(C=NC1)Br |
SPLASH |
splash10-00kr-9400000000-4e84c19a5603bd5bf1df |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
3-bromo-5-(2-nitroprop-1-en-1-yl)pyridine |
Technique |
GC/MS |
Wiley ID |
DD2024_005518 |