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ISOMADEIRANYL-ACETATE
SpectraBase Compound ID I3yacaVXzZM
InChI InChI=1S/C32H52O2/c1-20(2)32-17-12-21(3)27(32)31(9)16-13-23-24(30(31,8)18-19-32)10-11-25-28(5,6)26(34-22(4)33)14-15-29(23,25)7/h10,20-21,23,25-27H,11-19H2,1-9H3/t21-,23-,25-,26-,27-,29+,30+,31-,32+/m0/s1
InChIKey ONLASPILZCERNQ-AYCGOJHUSA-N
Mol Weight 468.8 g/mol
Molecular Formula C32H52O2
Exact Mass 468.396731 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DEXsP9fs7KY
Name ONLASPILZCERNQ-AYCGOJHUSA-N
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H52O2
InChI InChI=1S/C32H52O2/c1-20(2)32-17-12-21(3)27(32)31(9)16-13-23-24(30(31,8)18-19-32)10-11-25-28(5,6)26(34-22(4)33)14-15-29(23,25)7/h10,20-21,23,25-27H,11-19H2,1-9H3/t21-,23-,25-,26-,27-,29+,30+,31-,32+/m0/s1
InChIKey ONLASPILZCERNQ-AYCGOJHUSA-N
Literature Reference Author J.R.ASCENSO,M.J.U.FERREIRA
Literature Reference Citation MAGN.RES.CHEM.,35,643(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199709)35:9<643::aid-omr142>3.0.co;2-8
Molecular Weight 468.764 g/mol
Solvent CDCl3
Source File Reference UWCP4192