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(2Z)-2-(3,3-dicyano-2-phenyl-prop-2-enylidene)-5-methyl-4-thiazoline-3-carboxylic acid tert-butyl ester
SpectraBase Compound ID 4mdK7oOxMm2
InChI InChI=1S/C20H19N3O2S/c1-14-13-23(19(24)25-20(2,3)4)18(26-14)10-17(16(11-21)12-22)15-8-6-5-7-9-15/h5-10,13H,1-4H3/b18-10-
InChIKey XMHPSCCCOUZSBK-ZDLGFXPLSA-N
Mol Weight 365.45 g/mol
Molecular Formula C20H19N3O2S
Exact Mass 365.119798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GtuXzRABX7u
Name (2Z)-2-(3,3-dicyano-2-phenyl-prop-2-enylidene)-5-methyl-4-thiazoline-3-carboxylic acid tert-butyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C20H19N3O2S
InChI InChI=1S/C20H19N3O2S/c1-14-13-23(19(24)25-20(2,3)4)18(26-14)10-17(16(11-21)12-22)15-8-6-5-7-9-15/h5-10,13H,1-4H3/b18-10-
InChIKey XMHPSCCCOUZSBK-ZDLGFXPLSA-N
Molecular Weight 365.451 g/mol
SMILES C(\C=C\1N(C=C(S1)C)C(OC(C)(C)C)=O)(=C(C#N)C#N)c1ccccc1
SPLASH splash10-014i-0090000000-bdf4e6965e1198e8aa6d
Source of Spectrum Y-33-1794-9
Synonyms (2Z)-2-(3,3-dicyano-2-phenylprop-2-enylidene)-5-methyl-3-thiazolecarboxylic acid tert-butyl ester tert-butyl (2Z)-2-(3,3-dicyano-2-phenyl-prop-2-enylidene)-5-methyl-1,3-thiazole-3-carboxylate tert-butyl (2Z)-2-(3,3-dicyano-2-phenyl-prop-2-enylidene)-5-methyl-thiazole-3-carboxylate
Wiley ID 1351385