SpectraBase Spectrum ID |
8KJy5YRMOhs |
Name |
1-Phenyl-2-nitrobut-1-ene |
Classification |
Designer drug precursor |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
177.078978596 u |
Formula |
C10H11NO2 |
InChI |
InChI=1S/C10H11NO2/c1-2-10(11(12)13)8-9-6-4-3-5-7-9/h3-8H,2H2,1H3/b10-8- |
InChIKey |
ZWVYQTKQQAYACO-NTMALXAHSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
177.203 g/mol |
Nominal Mass |
177 u |
Quality |
990 |
Retention Index |
1463 |
SMILES |
C=1(\C=C\([N+](=O)[O-])CC)C=CC=CC1 |
SPLASH |
splash10-016u-9700000000-0af546a312941c5862cf |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(2-nitrobut-1-en-1-yl)benzene |
Technique |
GC/MS |
Wiley ID |
DD2024_005334 |