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TRANS-1-BENZYL-4-(METHOXYCARBONYLETHYLTHIO)-6-PHENYLPIPERIDINE-2-THIONE
SpectraBase Compound ID 6bYbA542BBP
InChI InChI=1S/C22H25NO2S2/c1-25-22(24)12-13-27-19-14-20(18-10-6-3-7-11-18)23(21(26)15-19)16-17-8-4-2-5-9-17/h2-11,19-20H,12-16H2,1H3/t19-,20+/m0/s1
InChIKey XULSKNHWQVJIDY-VQTJNVASSA-N
Mol Weight 399.57 g/mol
Molecular Formula C22H25NO2S2
Exact Mass 399.132671 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LsljxJBWgww
Name TRANS-1-BENZYL-4-(METHOXYCARBONYLETHYLTHIO)-6-PHENYLPIPERIDINE-2-THIONE
Compound Number 5J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25NO2S2
InChI InChI=1S/C22H25NO2S2/c1-25-22(24)12-13-27-19-14-20(18-10-6-3-7-11-18)23(21(26)15-19)16-17-8-4-2-5-9-17/h2-11,19-20H,12-16H2,1H3/t19-,20+/m0/s1
InChIKey XULSKNHWQVJIDY-VQTJNVASSA-N
Literature Reference Author J.G.SOSNICKI,T.S.JAGODZINSKI,J.LIEBSCHER
Literature Reference Citation J.HETCYCL.CHEM.,34,643(1997)
Literature Reference DOI 10.1002/jhet.5570340249
Molecular Weight 399.566 g/mol
Solvent CDCl3
Source File Reference WANG1638