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

*Links on SpectraBase are not permalinks.
5-Pyrimidinecarbonitrile, 1,4-dihydro-6-methyl-2-phenyl-4,4-bis(trifluoromethyl)-
SpectraBase Compound ID 2aBcGyc9NMn
InChI InChI=1S/C14H9F6N3/c1-8-10(7-21)12(13(15,16)17,14(18,19)20)23-11(22-8)9-5-3-2-4-6-9/h2-6H,1H3,(H,22,23)
InChIKey OQJRJOYWAQVOOL-UHFFFAOYSA-N
Mol Weight 333.24 g/mol
Molecular Formula C14H9F6N3
Exact Mass 333.070066 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 KLEcrulHNex
Name 5-Pyrimidinecarbonitrile, 1,4-dihydro-6-methyl-2-phenyl-4,4-bis(trifluoromethyl)-
Alternate Name(s) 6-Methyl-2-phenyl-4,4-bis(trifluoromethyl)-1,4-dihydropyrimidine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9F6N3
InChI InChI=1S/C14H9F6N3/c1-8-10(7-21)12(13(15,16)17,14(18,19)20)23-11(22-8)9-5-3-2-4-6-9/h2-6H,1H3,(H,22,23)
InChIKey OQJRJOYWAQVOOL-UHFFFAOYSA-N
Molecular Weight 333.237 g/mol
SMILES N1C(=NC(C(=C1C)C#N)(C(F)(F)F)C(F)(F)F)c1ccccc1
SPLASH splash10-03di-4590000000-9bee11e531ea475c47d7
Source of Spectrum IY-2-4836-9
Wiley ID 1656352