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TRIMETHYL-3,3',3''-(1,3,5-BENZENETRIACETYL)-TRIS-(2-METHYLDITHIOCARBAZATE)
SpectraBase Compound ID CeRVmTDDCNW
InChI InChI=1S/C21H30N6O3S6/c1-25(19(31)34-4)22-16(28)10-13-7-14(11-17(29)23-26(2)20(32)35-5)9-15(8-13)12-18(30)24-27(3)21(33)36-6/h7-9H,10-12H2,1-6H3,(H,22,28)(H,23,29)(H,24,30)
InChIKey OKJUHPGOZQCCOK-UHFFFAOYSA-N
Mol Weight 606.9 g/mol
Molecular Formula C21H30N6O3S6
Exact Mass 606.070366 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H2Embs3vLvw
Name TRIMETHYL-3,3',3''-(1,3,5-BENZENETRIACETYL)-TRIS-(2-METHYLDITHIOCARBAZATE)
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30N6O3S6
InChI InChI=1S/C21H30N6O3S6/c1-25(19(31)34-4)22-16(28)10-13-7-14(11-17(29)23-26(2)20(32)35-5)9-15(8-13)12-18(30)24-27(3)21(33)36-6/h7-9H,10-12H2,1-6H3,(H,22,28)(H,23,29)(H,24,30)
InChIKey OKJUHPGOZQCCOK-UHFFFAOYSA-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 606.868 g/mol
Solvent Unknown
Source File Reference UWCP6790