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5-ALPHA-CHOLESTAN-5-YL-ACETATE
SpectraBase Compound ID 5IllyOWgVrd
InChI InChI=1S/C29H50O2/c1-20(2)10-9-11-21(3)24-12-13-25-23-14-19-29(31-22(4)30)17-8-7-16-28(29,6)26(23)15-18-27(24,25)5/h20-21,23-26H,7-19H2,1-6H3/t21-,23+,24-,25+,26+,27-,28-,29+/m1/s1
InChIKey YUCXDKWAUOZUPS-MJRPSEIDSA-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 5y114kfSnOK
Name 5-ALPHA-CHOLESTAN-5-YL-ACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H50O2
InChI InChI=1S/C29H50O2/c1-20(2)10-9-11-21(3)24-12-13-25-23-14-19-29(31-22(4)30)17-8-7-16-28(29,6)26(23)15-18-27(24,25)5/h20-21,23-26H,7-19H2,1-6H3/t21-,23+,24-,25+,26+,27-,28-,29+/m1/s1
InChIKey YUCXDKWAUOZUPS-MJRPSEIDSA-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 UNIW3895