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ALL-E-3,4,7,8-TETRAHYDROSPHEROIDENE
SpectraBase Compound ID KcwzWcyfT1N
InChI InChI=1S/C41H64O/c1-34(2)20-14-23-37(5)26-17-29-38(6)27-15-24-35(3)21-12-13-22-36(4)25-16-28-39(7)30-18-31-40(8)32-19-33-41(9,10)42-11/h12-13,15-16,20-22,24-28,31H,14,17-19,23,29-30,32-33H2,1-11H3/b13-12+,24-15+,25-16+,35-21+,36-22+,37-26+,38-27+,39-28+,40-31+
InChIKey FWAXXZCFOZHAML-GXUPGZOGSA-N
Mol Weight 573.0 g/mol
Molecular Formula C41H64O
Exact Mass 572.495717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5pF5T49s9HS
Name ALL-E-3,4,7,8-TETRAHYDROSPHEROIDENE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H64O
InChI InChI=1S/C41H64O/c1-34(2)20-14-23-37(5)26-17-29-38(6)27-15-24-35(3)21-12-13-22-36(4)25-16-28-39(7)30-18-31-40(8)32-19-33-41(9,10)42-11/h12-13,15-16,20-22,24-28,31H,14,17-19,23,29-30,32-33H2,1-11H3/b13-12+,24-15+,25-16+,35-21+,36-22+,37-26+,38-27+,39-28+,40-31+
InChIKey FWAXXZCFOZHAML-GXUPGZOGSA-N
Literature Reference Author R.GEBHARD,J.T.M.VANDIJK,E.VANOUWERKERK,M.V.T.J.BOZA,J.LUGTEN BURG
Literature Reference Citation REC.TR.CH.P.-B.,110,459(1991)
Literature Reference DOI 10.1002/recl.19911101105
Molecular Weight 572.959 g/mol
Solvent CDCl3
Source File Reference UWTS2277