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ALPHA,OMEGA-BIS-(9-THIO-1,2,3,4-TETRAHYDROACRIDINIUM-9-YL-CHLORIDE)-BUTANE
SpectraBase Compound ID Ee2xLDNLYwO
InChI InChI=1S/C30H32N2S2.2ClH/c1-5-15-25-21(11-1)29(22-12-2-6-16-26(22)31-25)33-19-9-10-20-34-30-23-13-3-7-17-27(23)32-28-18-8-4-14-24(28)30;;/h1,3,5,7,11,13,15,17H,2,4,6,8-10,12,14,16,18-20H2;2*1H
InChIKey JMKBKHJMDFZPBV-UHFFFAOYSA-N
Mol Weight 557.64 g/mol
Molecular Formula C30H34Cl2N2S2
Exact Mass 556.154047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EsM1oI8HHFK
Name ALPHA,OMEGA-BIS-(9-THIO-1,2,3,4-TETRAHYDROACRIDINIUM-9-YL-CHLORIDE)-BUTANE
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H34Cl2N2S2
InChI InChI=1S/C30H32N2S2.2ClH/c1-5-15-25-21(11-1)29(22-12-2-6-16-26(22)31-25)33-19-9-10-20-34-30-23-13-3-7-17-27(23)32-28-18-8-4-14-24(28)30;;/h1,3,5,7,11,13,15,17H,2,4,6,8-10,12,14,16,18-20H2;2*1H
InChIKey JMKBKHJMDFZPBV-UHFFFAOYSA-N
Literature Reference Author R.FAURE,P.POULALLION,J.P.GALY,G.GIOVANANGELLI,J.C.SOYFER,J.B ARBE
Literature Reference Citation MAGN.RES.CHEM.,23,991(1985)
Literature Reference DOI 10.1002/mrc.1260231122
Molecular Weight 557.639 g/mol
Solvent CDCl3
Source File Reference UWCS12858