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TOTARA-8,11,13-TRIENE-6-ALPHA,13-DIOL

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TOTARA-8,11,13-TRIENE-6-ALPHA,13-DIOL
SpectraBase Compound ID CWFtoNh36vT
InChI InChI=1S/2C20H30O2/c2*1-12(2)17-13-11-16(22)18-19(3,4)9-6-10-20(18,5)14(13)7-8-15(17)21/h2*7-8,12,16,18,21-22H,6,9-11H2,1-5H3/t2*16-,18-,20+/m00/s1
InChIKey CSZLKEZOIUWZFN-YMAOVQTISA-N
Mol Weight 604.92 g/mol
Molecular Formula C40H60O4
Exact Mass 604.44916 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 96iBSOozNn
Name TOTARA-8,11,13-TRIENE-6-ALPHA,13-DIOL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H60O4
InChI InChI=1S/2C20H30O2/c2*1-12(2)17-13-11-16(22)18-19(3,4)9-6-10-20(18,5)14(13)7-8-15(17)21/h2*7-8,12,16,18,21-22H,6,9-11H2,1-5H3/t2*16-,18-,20+/m00/s1
InChIKey CSZLKEZOIUWZFN-YMAOVQTISA-N
Literature Reference Author G.B.EVANS,R.H.FURNEAUX,G.J.GAINSFORD,M.P.MURPHY
Literature Reference Citation BIOORG.MED.CHEM.,8,1663(2000)
Literature Reference DOI 10.1016/S0968-0896(00)00096-1
Molecular Weight 604.914 g/mol
Solvent CDCl3
Source File Reference UWVN20312