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3-Cyano-1-hexyl-6-hydroxy-5-(2-nitrophenylazo)-4-trifluoromethyl-2-pyridone
SpectraBase Compound ID Dx7DqxI6qxc
InChI InChI=1S/C19H18F3N5O4/c1-2-3-4-7-10-26-17(28)12(11-23)15(19(20,21)22)16(18(26)29)25-24-13-8-5-6-9-14(13)27(30)31/h5-6,8-9,29H,2-4,7,10H2,1H3/b25-24+
InChIKey RQJJAAHNGCNXQQ-OCOZRVBESA-N
Mol Weight 437.38 g/mol
Molecular Formula C19H18F3N5O4
Exact Mass 437.131089 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDrKwDeKeKO
Name 3-Cyano-1-hexyl-6-hydroxy-5-(2-nitrophenylazo)-4-trifluoromethyl-2-pyridone
Alternate Name(s) 1-Hexyl-6-hydroxy-5-[(E)-(2-nitrophenyl)diazenyl]-2-oxo-4-(trifluoromethyl)-1,2-dihydro-3-pyridinecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18F3N5O4
InChI InChI=1S/C19H18F3N5O4/c1-2-3-4-7-10-26-17(28)12(11-23)15(19(20,21)22)16(18(26)29)25-24-13-8-5-6-9-14(13)27(30)31/h5-6,8-9,29H,2-4,7,10H2,1H3/b25-24+
InChIKey RQJJAAHNGCNXQQ-OCOZRVBESA-N
Molecular Weight 437.379 g/mol
SMILES OC1=C(C(=C(C#N)C(N1CCCCCC)=O)C(F)(F)F)\N=N\c1c(N(=O)=O)cccc1
SPLASH splash10-001i-9030200000-fd4be6fb8d1a6427e03c
Source of Spectrum AJ-66-1793-10
Wiley ID 772015