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6-(2-[BIS-(METHYLTHIO)-METHYL]-3-INDOLYL)-1-METHYL-1,6-DIHYDROPYRIDINE-3-CARBALDEHYDE
SpectraBase Compound ID 5wWIfN1i3GB
InChI InChI=1S/C18H20N2OS2/c1-20-10-12(11-21)8-9-15(20)16-13-6-4-5-7-14(13)19-17(16)18(22-2)23-3/h4-11,15,18-19H,1-3H3
InChIKey KADPZVCGKSSCNV-UHFFFAOYSA-N
Mol Weight 344.49 g/mol
Molecular Formula C18H20N2OS2
Exact Mass 344.101706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ug3puvsHA
Name 6-(2-[BIS-(METHYLTHIO)-METHYL]-3-INDOLYL)-1-METHYL-1,6-DIHYDROPYRIDINE-3-CARBALDEHYDE
Compound Number 8E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20N2OS2
InChI InChI=1S/C18H20N2OS2/c1-20-10-12(11-21)8-9-15(20)16-13-6-4-5-7-14(13)19-17(16)18(22-2)23-3/h4-11,15,18-19H,1-3H3
InChIKey KADPZVCGKSSCNV-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 344.490 g/mol
Solvent CDCl3
Source File Reference UWCS3914