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(-)-CENTROLOBIN

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(-)-CENTROLOBIN
SpectraBase Compound ID LDSbPllXK2f
InChI InChI=1S/C20H24O3/c1-22-18-13-8-16(9-14-18)20-4-2-3-19(23-20)12-7-15-5-10-17(21)11-6-15/h5-6,8-11,13-14,19-21H,2-4,7,12H2,1H3/t19-,20+/m0/s1
InChIKey VKLGDLFSGNHXAV-VQTJNVASSA-N
Mol Weight 312.41 g/mol
Molecular Formula C20H24O3
Exact Mass 312.172545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5DvEdOC7oO7
Name (-)-CENTROLOBIN
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24O3
InChI InChI=1S/C20H24O3/c1-22-18-13-8-16(9-14-18)20-4-2-3-19(23-20)12-7-15-5-10-17(21)11-6-15/h5-6,8-11,13-14,19-21H,2-4,7,12H2,1H3/t19-,20+/m0/s1
InChIKey VKLGDLFSGNHXAV-VQTJNVASSA-N
Literature Reference Author A.F.D.C.ALCANTARA,M.R.SOUZA,D.PILO-VELOSO
Literature Reference Citation FITOTERAPIA,71,613(2000)
Literature Reference DOI 10.1016/S0367-326X(00)00196-9
Molecular Weight 312.409 g/mol
Solvent CDCl3
Source File Reference UWVN3882