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N-ACETYLCINCHONICINOL;MAJOR-ISOMER

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N-ACETYLCINCHONICINOL;MAJOR-ISOMER
SpectraBase Compound ID F9lMzcQvqcU
InChI InChI=1S/C21H26N2O2/c1-3-16-14-23(15(2)24)13-11-17(16)8-9-21(25)19-10-12-22-20-7-5-4-6-18(19)20/h3-7,10,12,16-17,21,25H,1,8-9,11,13-14H2,2H3/t16-,17+,21+/m0/s1
InChIKey MGPFTVVETKCWEH-CSODHUTKSA-N
Mol Weight 338.45 g/mol
Molecular Formula C21H26N2O2
Exact Mass 338.199428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2nBhauUz1Sz
Name N-ACETYLCINCHONICINOL;MAJOR-ISOMER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26N2O2
InChI InChI=1S/C21H26N2O2/c1-3-16-14-23(15(2)24)13-11-17(16)8-9-21(25)19-10-12-22-20-7-5-4-6-18(19)20/h3-7,10,12,16-17,21,25H,1,8-9,11,13-14H2,2H3/t16-,17+,21+/m0/s1
InChIKey MGPFTVVETKCWEH-CSODHUTKSA-N
Literature Reference Author J.G.DIAZ,J.G.SAZATORNIL,M.L.RODRIGUEZ,L.R.MESIA,G.V.ARANA
Literature Reference Citation J.NAT.PROD.,67,1667(2004)
Literature Reference DOI 10.1021/np040053k
Molecular Weight 338.450 g/mol
Solvent CDCl3
Source File Reference UWMZ6523