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8-(METHYLSULFANYL)-7,8-DIHYDROBERBERINE

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8-(METHYLSULFANYL)-7,8-DIHYDROBERBERINE
SpectraBase Compound ID BNEKY5Ml1pV
InChI InChI=1S/C21H21NO4S/c1-23-16-5-4-13-8-15-14-10-18-17(25-11-26-18)9-12(14)6-7-22(15)21(27-3)19(13)20(16)24-2/h4-5,8-10,21H,6-7,11H2,1-3H3
InChIKey KYGFTPRKMAMQTO-UHFFFAOYSA-N
Mol Weight 383.46 g/mol
Molecular Formula C21H21NO4S
Exact Mass 383.119129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID NoSCIFawTi
Name 8-(METHYLSULFANYL)-7,8-DIHYDROBERBERINE
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21NO4S
InChI InChI=1S/C21H21NO4S/c1-23-16-5-4-13-8-15-14-10-18-17(25-11-26-18)9-12(14)6-7-22(15)21(27-3)19(13)20(16)24-2/h4-5,8-10,21H,6-7,11H2,1-3H3
InChIKey KYGFTPRKMAMQTO-UHFFFAOYSA-N
Literature Reference Author L.GRYCOVA,D.HULOVA,L.MAIER,S.STANDARA,M.NECAS,F.LEMIERE,R.KA RES,J.DOSTAL,R.MAREK
Literature Reference Citation MAGN.RES.CHEM.,46,1127(2008)
Literature Reference DOI 10.1002/mrc.2325
Molecular Weight 383.462 g/mol
Solvent C6D6
Source File Reference UWBT16357