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4-(2-[BIS-(METHYLTHIO)-METHYL]-1-(METHOXYCARBONYL)-3-INDOLYL)-1-METHYL-1,4-DIHYDROPYRIDINE-3-CARBALDEHYDE
SpectraBase Compound ID Fm1RdfA7zr8
InChI InChI=1S/C20H22N2O3S2/c1-21-10-9-13(11-14(21)12-23)17-15-7-5-6-8-16(15)22(20(24)25-2)18(17)19(26-3)27-4/h5-13,19H,1-4H3
InChIKey YSXAGWYQBYGPDX-UHFFFAOYSA-N
Mol Weight 402.53 g/mol
Molecular Formula C20H22N2O3S2
Exact Mass 402.107185 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6YkLnuWTsRJ
Name 4-(2-[BIS-(METHYLTHIO)-METHYL]-1-(METHOXYCARBONYL)-3-INDOLYL)-1-METHYL-1,4-DIHYDROPYRIDINE-3-CARBALDEHYDE
Compound Number 9K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22N2O3S2
InChI InChI=1S/C20H22N2O3S2/c1-21-10-9-13(11-14(21)12-23)17-15-7-5-6-8-16(15)22(20(24)25-2)18(17)19(26-3)27-4/h5-13,19H,1-4H3
InChIKey YSXAGWYQBYGPDX-UHFFFAOYSA-N
Literature Reference Author M.L.BENNASAR,E.ZULAICA,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,57,2835(1992)
Literature Reference DOI 10.1021/jo00036a015
Molecular Weight 402.526 g/mol
Solvent CDCl3
Source File Reference UWCS3922