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

*Links on SpectraBase are not permalinks.
3-Cyano-1-hexyl-6-hydroxy-5-[2-(perfluorooctyl)phenylazo]-4-trifluoromethyl-2-pyridone
SpectraBase Compound ID HDk1XnTfh5X
InChI InChI=1S/C27H18F20N4O2/c1-2-3-4-7-10-51-17(52)12(11-48)15(20(30,31)32)16(18(51)53)50-49-14-9-6-5-8-13(14)19(28,29)21(33,34)22(35,36)23(37,38)24(39,40)25(41,42)26(43,44)27(45,46)47/h5-6,8-9,53H,2-4,7,10H2,1H3/b50-49+
InChIKey PGLNLZOTDFTIBY-BNEIJSFPSA-N
Mol Weight 810.44 g/mol
Molecular Formula C27H18F20N4O2
Exact Mass 810.111039 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 J0it6hrpztY
Name 3-Cyano-1-hexyl-6-hydroxy-5-[2-(perfluorooctyl)phenylazo]-4-trifluoromethyl-2-pyridone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H18F20N4O2
InChI InChI=1S/C27H18F20N4O2/c1-2-3-4-7-10-51-17(52)12(11-48)15(20(30,31)32)16(18(51)53)50-49-14-9-6-5-8-13(14)19(28,29)21(33,34)22(35,36)23(37,38)24(39,40)25(41,42)26(43,44)27(45,46)47/h5-6,8-9,53H,2-4,7,10H2,1H3/b50-49+
InChIKey PGLNLZOTDFTIBY-BNEIJSFPSA-N
Molecular Weight 810.435 g/mol
SMILES OC1=C(C(=C(C#N)C(N1CCCCCC)=O)C(F)(F)F)\N=N\c1c(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)cccc1
SPLASH splash10-001i-9110000020-6385b88c6bcb47955120
Source of Spectrum AJ-66-1794-10
Synonyms 3-Cyano-1-hexyl-6-hydroxy-5-[2-(perfluorohoctyl)phenylazo]-4-trifluoromethyl-2-pyridone 5-[(E)-2-[2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)phenyl]diazen-1-yl]-1-hexyl-6-hydroxy-2-oxo-4-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile
Wiley ID 772011