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5-[1,3-bis[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-yl]-4-methyldithiole-3-thione

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5-[1,3-bis[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-yl]-4-methyldithiole-3-thione
SpectraBase Compound ID LH4VDLJWaew
InChI InChI=1S/C29H38N4O2S3/c1-22-28(37-38-29(22)36)23(20-30-12-16-32(17-13-30)24-8-4-6-10-26(24)34-2)21-31-14-18-33(19-15-31)25-9-5-7-11-27(25)35-3/h4-11,23H,12-21H2,1-3H3
InChIKey ZBKRGWWCNBYOLV-UHFFFAOYSA-N
Mol Weight 570.8 g/mol
Molecular Formula C29H38N4O2S3
Exact Mass 570.21569 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 94cJqxEik8P
Name 5-[1,3-bis[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-yl]-4-methyldithiole-3-thione
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H38N4O2S3
InChI InChI=1S/C29H38N4O2S3/c1-22-28(37-38-29(22)36)23(20-30-12-16-32(17-13-30)24-8-4-6-10-26(24)34-2)21-31-14-18-33(19-15-31)25-9-5-7-11-27(25)35-3/h4-11,23H,12-21H2,1-3H3
InChIKey ZBKRGWWCNBYOLV-UHFFFAOYSA-N
Literature Reference Author C.VACCHER,P.BERTHELOT,M.DEBAERT
Literature Reference Citation J.HETCYCL.CHEM.,30,545(1993)
Literature Reference DOI 10.1002/jhet.5570300247
Molecular Weight 570.826 g/mol
Solvent CDCl3
Source File Reference UWGE147