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

*Links on SpectraBase are not permalinks.
[7-(TRIFLUOROACETYL)-CYCLOPENTA-[C]-PYRAN-3-YL]-ACETONITRILE
SpectraBase Compound ID IdJfwdKvNiN
InChI InChI=1S/C12H6F3NO2/c13-12(14,15)11(17)9-2-1-7-5-8(3-4-16)18-6-10(7)9/h1-2,5-6H,3H2
InChIKey IUUSFRQVHFAVIR-UHFFFAOYSA-N
Mol Weight 253.18 g/mol
Molecular Formula C12H6F3NO2
Exact Mass 253.035063 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 BiCplTrGuJk
Name 2-[7-(2,2,2-trifluoro-1-oxoethyl)-3-cyclopenta[c]pyranyl]acetonitrile
Alternate Name(s) 2-[7-(2,2,2-trifluoroacetyl)cyclopenta[c]pyran-3-yl]acetonitrile 2-[7-[2,2,2-tris(fluoranyl)ethanoyl]cyclopenta[c]pyran-3-yl]ethanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6F3NO2
InChI InChI=1S/C12H6F3NO2/c13-12(14,15)11(17)9-2-1-7-5-8(3-4-16)18-6-10(7)9/h1-2,5-6H,3H2
InChIKey IUUSFRQVHFAVIR-UHFFFAOYSA-N
Molecular Weight 253.180 g/mol
SMILES C(CC1=CC=2C(=CO1)C(=CC2)C(=O)C(F)(F)F)#N
SPLASH splash10-0udi-0950000000-2c45373751eaa71c644b
Source of Spectrum K1-0-540-27
Wiley ID 1588312