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3-Cyano-1-hexyl-6-hydroxy-5-[2-(perfluorohexyl)phenylazo]-4-trifluoromethyl-2-pyridone
SpectraBase Compound ID 1GsqfpXZpON
InChI InChI=1S/C25H18F16N4O2/c1-2-3-4-7-10-45-17(46)12(11-42)15(20(28,29)30)16(18(45)47)44-43-14-9-6-5-8-13(14)19(26,27)21(31,32)22(33,34)23(35,36)24(37,38)25(39,40)41/h5-6,8-9,47H,2-4,7,10H2,1H3/b44-43+
InChIKey HZCDRWOGPUJBSU-VGFSZAGXSA-N
Mol Weight 710.42 g/mol
Molecular Formula C25H18F16N4O2
Exact Mass 710.117426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhPSUGejqUZ
Name 3-Cyano-1-hexyl-6-hydroxy-5-[2-(perfluorohexyl)phenylazo]-4-trifluoromethyl-2-pyridone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H18F16N4O2
InChI InChI=1S/C25H18F16N4O2/c1-2-3-4-7-10-45-17(46)12(11-42)15(20(28,29)30)16(18(45)47)44-43-14-9-6-5-8-13(14)19(26,27)21(31,32)22(33,34)23(35,36)24(37,38)25(39,40)41/h5-6,8-9,47H,2-4,7,10H2,1H3/b44-43+
InChIKey HZCDRWOGPUJBSU-VGFSZAGXSA-N
Molecular Weight 710.419 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(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)cccc1
SPLASH splash10-0002-0903200100-388752f700edd08bd695
Source of Spectrum AJ-66-1794-10
Synonyms 1-Hexyl-6-hydroxy-2-oxo-5-{(E)-[2-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)phenyl]diazenyl}-4-(trifluoromethyl)-1,2-dihydro-3-pyridinecarbonitrile
Wiley ID 772012