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3,5-bis(chloranyl)-6-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-pyridine-2-carbonitrile

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3,5-bis(chloranyl)-6-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-pyridine-2-carbonitrile
SpectraBase Compound ID 2g4RWZrwieJ
InChI InChI=1S/C20H22Cl2N2OS/c1-19(2,3)12-7-11(8-13(17(12)25)20(4,5)6)26-18-15(22)9-14(21)16(10-23)24-18/h7-9,25H,1-6H3
InChIKey BSRJOHYEZKLQQI-UHFFFAOYSA-N
Mol Weight 409.38 g/mol
Molecular Formula C20H22Cl2N2OS
Exact Mass 408.08299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2tjodRY53Qn
Name 3,5-bis(chloranyl)-6-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-pyridine-2-carbonitrile
Alternate Name(s) 3,5-Dichloro-6-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]picolinonitrile 3,5-Dichloro-6-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-2-pyridinecarbonitrile 3,5-Dichloro-6-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpyridine-2-carbonitrile
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Formula C20H22Cl2N2OS
InChI InChI=1S/C20H22Cl2N2OS/c1-19(2,3)12-7-11(8-13(17(12)25)20(4,5)6)26-18-15(22)9-14(21)16(10-23)24-18/h7-9,25H,1-6H3
InChIKey BSRJOHYEZKLQQI-UHFFFAOYSA-N
Molecular Weight 409.375 g/mol
SMILES Oc1c(cc(Sc2nc(c(cc2Cl)Cl)C#N)cc1C(C)(C)C)C(C)(C)C
SPLASH splash10-0btc-2839800000-789a7fdf64ba1021ef09
Wiley ID 1463940