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1(4),6(4)-DIALLYL-7,13-DITHIA-1,6(3,5)-DI-(1,2,4-TRIAZOLA)-CYCLOTRIDECAPHANE
SpectraBase Compound ID 4D7H3zaoL2I
InChI InChI=1S/C19H28N6S2/c1-3-12-24-16-10-6-7-11-17-21-23-19(25(17)13-4-2)27-15-9-5-8-14-26-18(24)22-20-16/h3-4H,1-2,5-15H2
InChIKey LARPWUXRNWUEON-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C19H28N6S2
Exact Mass 404.181687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7zjzN0VTVLD
Name 1(4),6(4)-DIALLYL-7,13-DITHIA-1,6(3,5)-DI-(1,2,4-TRIAZOLA)-CYCLOTRIDECAPHANE
Compound Number 5I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H28N6S2
InChI InChI=1S/C19H28N6S2/c1-3-12-24-16-10-6-7-11-17-21-23-19(25(17)13-4-2)27-15-9-5-8-14-26-18(24)22-20-16/h3-4H,1-2,5-15H2
InChIKey LARPWUXRNWUEON-UHFFFAOYSA-N
Literature Reference Author M.S.CHANDE,K.A.PUTHAMANE,P.A.BARVE,R.R.KHANWELKAR,D.S.VENKAT ARAMAN
Literature Reference Citation J.BRAZ.CHEM.SOC.,19,42(2008)
Literature Reference DOI 10.1590/s0103-50532008000100008
Molecular Weight 404.592 g/mol
Source File Reference UWIR5119