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[4-tert-Butyl-3-(3-trifluoromethylphenyl)-2,3-dihydrothiazol-2-ylidene]cyanoacetic acid ethyl ester
SpectraBase Compound ID 7QFraX2yknr
InChI InChI=1S/C19H19F3N2O2S/c1-5-26-17(25)14(10-23)16-24(15(11-27-16)18(2,3)4)13-8-6-7-12(9-13)19(20,21)22/h6-9,11H,5H2,1-4H3/b16-14-
InChIKey RWFKYCOGRZNJHS-PEZBUJJGSA-N
Mol Weight 396.43 g/mol
Molecular Formula C19H19F3N2O2S
Exact Mass 396.111934 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hqbWl4icR2
Name [4-tert-Butyl-3-(3-trifluoromethylphenyl)-2,3-dihydrothiazol-2-ylidene]cyanoacetic acid ethyl ester
Alternate Name(s) (Z)-ethyl 2-(4-(tert-butyl)-3-(3-(trifluoromethyl)phenyl)thiazol-2(3H)-ylidene)-2-cyanoacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19F3N2O2S
InChI InChI=1S/C19H19F3N2O2S/c1-5-26-17(25)14(10-23)16-24(15(11-27-16)18(2,3)4)13-8-6-7-12(9-13)19(20,21)22/h6-9,11H,5H2,1-4H3/b16-14-
InChIKey RWFKYCOGRZNJHS-PEZBUJJGSA-N
Literature Reference DOI 10.1002_1521-3897(200006)342_6_554
Molecular Weight 396.428 g/mol
SMILES c1ccc(cc1C(F)(F)F)N1C(=CS\C1=C\(C(=O)OCC)C#N)C(C)(C)C
SPLASH splash10-006t-0009000000-3c8d04e2c1b0cf92a2bf
Source of Spectrum JF-342-559-8c
Wiley ID 1767047