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t-Butyl 2-[3',3'-dicyano-2'-(4"-methylphenyl)allylidene]-5-methylenethiazole-3-carboxylate
SpectraBase Compound ID 8RZ8K0wXYPs
InChI InChI=1S/C21H21N3O2S/c1-14-6-8-17(9-7-14)18(10-16(11-22)12-23)19-24(13-15(2)27-19)20(25)26-21(3,4)5/h6-10H,2,13H2,1,3-5H3/b19-18+
InChIKey GVDIAZYQGWUKAP-VHEBQXMUSA-N
Mol Weight 379.48 g/mol
Molecular Formula C21H21N3O2S
Exact Mass 379.135448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90e558jibVw
Name t-Butyl 2-[3',3'-dicyano-2'-(4"-methylphenyl)allylidene]-5-methylenethiazole-3-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C21H21N3O2S
InChI InChI=1S/C21H21N3O2S/c1-14-6-8-17(9-7-14)18(10-16(11-22)12-23)19-24(13-15(2)27-19)20(25)26-21(3,4)5/h6-10H,2,13H2,1,3-5H3/b19-18+
InChIKey GVDIAZYQGWUKAP-VHEBQXMUSA-N
Molecular Weight 379.478 g/mol
SMILES C(\C(=C\1N(CC(S1)=C)C(OC(C)(C)C)=O)c1ccc(cc1)C)=C(C#N)C#N
SPLASH splash10-004i-0091000000-db6f4cfb8fe21b85603c
Source of Spectrum Y-33-1794-8
Synonyms tert-butyl (2E)-2-[3,3-dicyano-1-(4-methylphenyl)-2-propenylidene]-5-methylene-1,3-thiazolidine-3-carboxylate
Wiley ID 1359278