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2-{2-[4-tert-Butyl-3-(3-trifluormethylphenyl)-2,3-dihydrothiazol-2-yliden]-1-(4-methoxyphenyl)-ethyliden}malonic acid dinitrile
SpectraBase Compound ID AWxwU7wHblv
InChI InChI=1S/C26H22F3N3OS/c1-25(2,3)23-16-34-24(32(23)20-7-5-6-19(12-20)26(27,28)29)13-22(18(14-30)15-31)17-8-10-21(33-4)11-9-17/h5-13,16H,1-4H3/b24-13-
InChIKey QYFVSGWHEGYZAD-CFRMEGHHSA-N
Mol Weight 481.54 g/mol
Molecular Formula C26H22F3N3OS
Exact Mass 481.143568 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lpHQ9sroWT
Name 2-{2-[4-tert-Butyl-3-(3-trifluormethylphenyl)-2,3-dihydrothiazol-2-yliden]-1-(4-methoxyphenyl)-ethyliden}malonic acid dinitrile
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Formula C26H22F3N3OS
InChI InChI=1S/C26H22F3N3OS/c1-25(2,3)23-16-34-24(32(23)20-7-5-6-19(12-20)26(27,28)29)13-22(18(14-30)15-31)17-8-10-21(33-4)11-9-17/h5-13,16H,1-4H3/b24-13-
InChIKey QYFVSGWHEGYZAD-CFRMEGHHSA-N
Literature Reference DOI 10.1002_1521-3897(200006)342_6_554
Molecular Weight 481.537 g/mol
SMILES c1ccc(cc1C(F)(F)F)N1C(=CS\C1=C\C(=C(C#N)C#N)c1ccc(cc1)OC)C(C)(C)C
SPLASH splash10-001i-0120900000-b9414e02340508b97ffc
Source of Spectrum JF-342-559-10b
Synonyms (Z)-2-(2-(4-(tert-butyl)-3-(3-(trifluoromethyl)phenyl)thiazol-2(3H)-ylidene)-1-(4-methoxyphenyl)ethylidene)malononitrile
Wiley ID 1767029