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3-Cyano-1-hexyl-6-hydroxy-4-methyl-5-[2-(perfluorobutyl)phenylazo]-2-pyridone
SpectraBase Compound ID 33ElmrPEq1b
InChI InChI=1S/C23H21F9N4O2/c1-3-4-5-8-11-36-18(37)14(12-33)13(2)17(19(36)38)35-34-16-10-7-6-9-15(16)20(24,25)21(26,27)22(28,29)23(30,31)32/h6-7,9-10,38H,3-5,8,11H2,1-2H3/b35-34+
InChIKey VZBRGPIWLYHYSD-XAHDOWKMSA-N
Mol Weight 556.43 g/mol
Molecular Formula C23H21F9N4O2
Exact Mass 556.152079 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D42lwRnrXct
Name 3-Cyano-1-hexyl-6-hydroxy-4-methyl-5-[2-(perfluorobutyl)phenylazo]-2-pyridone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21F9N4O2
InChI InChI=1S/C23H21F9N4O2/c1-3-4-5-8-11-36-18(37)14(12-33)13(2)17(19(36)38)35-34-16-10-7-6-9-15(16)20(24,25)21(26,27)22(28,29)23(30,31)32/h6-7,9-10,38H,3-5,8,11H2,1-2H3/b35-34+
InChIKey VZBRGPIWLYHYSD-XAHDOWKMSA-N
Molecular Weight 556.433 g/mol
SMILES OC=1N(CCCCCC)C(C(=C(C1\N=N\c1c(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)cccc1)C)C#N)=O
SPLASH splash10-056u-4703090000-63dfac085b89b134f877
Source of Spectrum AJ-66-1793-7
Synonyms 1-Hexyl-6-hydroxy-4-methyl-5-{(E)-[2-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)phenyl]diazenyl}-2-oxo-1,2-dihydro-3-pyridinecarbonitrile 3-Cyano-1-hexyl-6-hydroxy-4-methyl-5-[2-(tperfluorobutyl)phenylazo]-2-pyridone
Wiley ID 772019