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8-TRICHLOROMETHYL-7,8-DIHYDROBERBERINE

View entire compound with spectra: 5 NMR

8-TRICHLOROMETHYL-7,8-DIHYDROBERBERINE
SpectraBase Compound ID LZFLIECyRSM
InChI InChI=1S/C21H18Cl3NO4/c1-26-15-4-3-12-7-14-13-9-17-16(28-10-29-17)8-11(13)5-6-25(14)20(21(22,23)24)18(12)19(15)27-2/h3-4,7-9,20H,5-6,10H2,1-2H3
InChIKey CAGHPRDTHLKFCW-UHFFFAOYSA-N
Mol Weight 454.74 g/mol
Molecular Formula C21H18Cl3NO4
Exact Mass 453.030141 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2NrRlPSoXgJ
Name 8-TRICHLOROMETHYL-7,8-DIHYDROBERBERINE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18Cl3NO4
InChI InChI=1S/C21H18Cl3NO4/c1-26-15-4-3-12-7-14-13-9-17-16(28-10-29-17)8-11(13)5-6-25(14)20(21(22,23)24)18(12)19(15)27-2/h3-4,7-9,20H,5-6,10H2,1-2H3
InChIKey CAGHPRDTHLKFCW-UHFFFAOYSA-N
Literature Reference Author R.MAREK,P.SECKAROVA,J.MAREK,J.DOSTAL,V.SKLENAR
Literature Reference Citation J.NAT.PROD.,66,481(2003)
Literature Reference DOI 10.1021/np0204996
Molecular Weight 454.737 g/mol
Solvent CDCl3
Source File Reference UWSI7582