For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1(3-(Trifluoromethyl)phenyl)-2-nitropropen
SpectraBase Compound ID 1i88hZvGtxH
InChI InChI=1S/C10H8F3NO2/c1-7(14(15)16)5-8-3-2-4-9(6-8)10(11,12)13/h2-6H,1H3/b7-5-
InChIKey KDMSDFWVSIRTOL-ALCCZGGFSA-N
Mol Weight 231.17 g/mol
Molecular Formula C10H8F3NO2
Exact Mass 231.050713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8HbIjewfl2m
Name 1(3-(Trifluoromethyl)phenyl)-2-nitropropen
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 231.050712989 u
Formula C10H8F3NO2
InChI InChI=1S/C10H8F3NO2/c1-7(14(15)16)5-8-3-2-4-9(6-8)10(11,12)13/h2-6H,1H3/b7-5-
InChIKey KDMSDFWVSIRTOL-ALCCZGGFSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 231.174 g/mol
Nominal Mass 231 u
Quality 987
Retention Index 1392
SMILES C1(C(F)(F)F)=CC(\C=C\([N+](=O)[O-])C)=CC=C1
SPLASH splash10-014i-6900000000-c909b03161fcec4659e3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(2-nitroprop-1-en-1-yl)-3-(trifluoromethyl)benzene
Technique GC/MS
Wiley ID DD2024_004463