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1-(3-(Trifluoromethyl)phenyl)-2-nitroethene
SpectraBase Compound ID Dlr8JOQXSXZ
InChI InChI=1S/C9H6F3NO2/c10-9(11,12)8-3-1-2-7(6-8)4-5-13(14)15/h1-6H/b5-4-
InChIKey GOKALPUCIXWJLV-PLNGDYQASA-N
Mol Weight 217.15 g/mol
Molecular Formula C9H6F3NO2
Exact Mass 217.035063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lgP4qoEW3M
Name 1-(3-(Trifluoromethyl)phenyl)-2-nitroethene
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 217.035062924 u
Formula C9H6F3NO2
InChI InChI=1S/C9H6F3NO2/c10-9(11,12)8-3-1-2-7(6-8)4-5-13(14)15/h1-6H/b5-4-
InChIKey GOKALPUCIXWJLV-PLNGDYQASA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 217.147 g/mol
Nominal Mass 217 u
Quality 981
Retention Index 1356
SMILES C(C1=CC(\C=C/[N+](=O)[O-])=CC=C1)(F)(F)F
SPLASH splash10-0udi-7900000000-a2e568b4029155b67158
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(2-nitroethenyl)-3-(trifluoromethyl)benzene
Technique GC/MS
Wiley ID DD2024_004451