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2,2',2''-(1,3,5-BENZENETRIYL)-TRIS-[4,5-DIHYDRO-4-METHYL-5-PROPYLIMINO-1,3,4-THIADIAZOLE]

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2,2',2''-(1,3,5-BENZENETRIYL)-TRIS-[4,5-DIHYDRO-4-METHYL-5-PROPYLIMINO-1,3,4-THIADIAZOLE]
SpectraBase Compound ID 4YUWUTMnRKG
InChI InChI=1S/C24H33N9S3/c1-7-10-25-22-31(4)28-19(34-22)16-13-17(20-29-32(5)23(35-20)26-11-8-2)15-18(14-16)21-30-33(6)24(36-21)27-12-9-3/h13-15H,7-12H2,1-6H3/b25-22+,26-23+,27-24+
InChIKey YMJMVZMYZHCYRK-NQXXUPRISA-N
Mol Weight 543.8 g/mol
Molecular Formula C24H33N9S3
Exact Mass 543.202106 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BZa894QWcLy
Name 2,2',2''-(1,3,5-BENZENETRIYL)-TRIS-[4,5-DIHYDRO-4-METHYL-5-PROPYLIMINO-1,3,4-THIADIAZOLE]
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H33N9S3
InChI InChI=1S/C24H33N9S3/c1-7-10-25-22-31(4)28-19(34-22)16-13-17(20-29-32(5)23(35-20)26-11-8-2)15-18(14-16)21-30-33(6)24(36-21)27-12-9-3/h13-15H,7-12H2,1-6H3/b25-22+,26-23+,27-24+
InChIKey YMJMVZMYZHCYRK-NQXXUPRISA-N
Literature Reference Author P.MOLINA,A.TARRAGA,I.DIAZ,A.ESPINOSA,C.GASPAR
Literature Reference Citation HETEROCYCLES,36,1263(1993)
Literature Reference DOI 10.3987/COM-92-6275
Molecular Weight 543.766 g/mol
Solvent CDCl3
Source File Reference UWCP6778