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

*Links on SpectraBase are not permalinks.
4-(Trifluoromethoxy)phenylacetonitrile
SpectraBase Compound ID 3Se8zWIAyuw
InChI InChI=1S/C9H6F3NO/c10-9(11,12)14-8-3-1-7(2-4-8)5-6-13/h1-4H,5H2
InChIKey LYFCAROXYJTUQF-UHFFFAOYSA-N
Mol Weight 201.15 g/mol
Molecular Formula C9H6F3NO
Exact Mass 201.040148 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 KDaRPrhKTSw
Name 2-(4-(trifluoromethoxy)phenyl)acetonitrile
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 201.040148305 u
Formula C9H6F3NO
InChI InChI=1S/C9H6F3NO/c10-9(11,12)14-8-3-1-7(2-4-8)5-6-13/h1-4H,5H2
InChIKey LYFCAROXYJTUQF-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.202216160
Molecular Weight 201.148 g/mol
Quality 470
SMILES C(OC1=CC=C(C=C1)CC#N)(F)(F)F
SPLASH splash10-0uxr-4960000000-a289f3de6a99b8ba96b4
Source of Spectrum ACI-62-SM48-14 (DOI: 10.1002/anie.202216160)
Thin-Layer Chromatography 0.30 (Cy/EtOAc, 9:1)
Wiley ID 1908408