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2-(Trifluoromethoxy)benzonitrile
SpectraBase Compound ID 8kqKeYizdkE
InChI InChI=1S/C8H4F3NO/c9-8(10,11)13-7-4-2-1-3-6(7)5-12/h1-4H
InChIKey ACNBBQGAWMHXLA-UHFFFAOYSA-N
Mol Weight 187.12 g/mol
Molecular Formula C8H4F3NO
Exact Mass 187.024498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NfOlW0MfiK
Name 2-(Trifluoromethoxy)benzonitrile
Appearance Clear yellow oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 187.024498241 u
Formula C8H4F3NO
InChI InChI=1S/C8H4F3NO/c9-8(10,11)13-7-4-2-1-3-6(7)5-12/h1-4H
InChIKey ACNBBQGAWMHXLA-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600549
Molecular Weight 187.121 g/mol
Quality 375
SMILES C1=CC(=C(C=C1)C#N)OC(F)(F)F
SPLASH splash10-0670-9700000000-b59b9587caaf13bf05eb
Source of Spectrum QE-22-SM6-Table 2, entry 5 (DOI: 10.1002/chem.201600549)
Wiley ID 1903102