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5-ALPHA-CHOLESTAN-6-ALPHA-YL-ACETATE
SpectraBase Compound ID Iv6riY2wIXr
InChI InChI=1S/C29H50O2/c1-19(2)10-9-11-20(3)23-13-14-24-22-18-27(31-21(4)30)26-12-7-8-16-28(26,5)25(22)15-17-29(23,24)6/h19-20,22-27H,7-18H2,1-6H3/t20-,22+,23-,24+,25+,26-,27+,28-,29-/m1/s1
InChIKey NKRDVLNBFLSPFN-BCJNDUEPSA-N
Mol Weight 430.7 g/mol
Molecular Formula C29H50O2
Exact Mass 430.381081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KhK5015X6j
Name 5-ALPHA-CHOLESTAN-6-ALPHA-YL-ACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H50O2
InChI InChI=1S/C29H50O2/c1-19(2)10-9-11-20(3)23-13-14-24-22-18-27(31-21(4)30)26-12-7-8-16-28(26,5)25(22)15-17-29(23,24)6/h19-20,22-27H,7-18H2,1-6H3/t20-,22+,23-,24+,25+,26-,27+,28-,29-/m1/s1
InChIKey NKRDVLNBFLSPFN-BCJNDUEPSA-N
Literature Reference Author J.W.BLUNT,J.B.STOTHERS
Literature Reference Citation ORG.MAGN.RES.,9,439(1977)
Literature Reference DOI 10.1002/mrc.1270090802
Molecular Weight 430.715 g/mol
Solvent CDCl3
Source File Reference UNIW1914