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THALIANOL;(3S,13S,14R)-MALABARICA-8,17,21-TRIEN-3-OL
SpectraBase Compound ID BooZz4FKYtG
InChI InChI=1S/C30H50O/c1-21(2)11-9-12-22(3)13-10-14-23(4)29(7)19-17-25-24(29)15-16-26-28(5,6)27(31)18-20-30(25,26)8/h11,13,23,26-27,31H,9-10,12,14-20H2,1-8H3/b22-13+/t23-,26-,27-,29+,30+/m0/s1
InChIKey DGAGPZOBTQYNRE-NQCQTZSJSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HA5WPJGp8dz
Name THALIANOL;(3S,13S,14R)-MALABARICA-8,17,21-TRIEN-3-OL
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-21(2)11-9-12-22(3)13-10-14-23(4)29(7)19-17-25-24(29)15-16-26-28(5,6)27(31)18-20-30(25,26)8/h11,13,23,26-27,31H,9-10,12,14-20H2,1-8H3/b22-13+/t23-,26-,27-,29+,30+/m0/s1
InChIKey DGAGPZOBTQYNRE-NQCQTZSJSA-N
Literature Reference Author G.C.FAZIO,R.XU,S.P.T.MATSUDA
Literature Reference Citation J.AM.CHEM.SOC.,126,5678(2004)
Literature Reference DOI 10.1021/ja0318784
Molecular Weight 426.726 g/mol
Sample ID 31306
Solvent CDCl3