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5a-Cholestane-3b,6b-diol-6b-acetate
SpectraBase Compound ID Olasphx5Ct
InChI InChI=1S/C29H50O3/c1-18(2)8-7-9-19(3)23-10-11-24-22-17-27(32-20(4)30)26-16-21(31)12-14-29(26,6)25(22)13-15-28(23,24)5/h18-19,21-27,31H,7-17H2,1-6H3
InChIKey HSTARSFCWAPQER-UHFFFAOYSA-N
Mol Weight 446.7 g/mol
Molecular Formula C29H50O3
Exact Mass 446.375995 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5N08wTqPqmu
Name 5a-Cholestane-3b,6b-diol-6b-acetate
CAS Registry Number 26358-65-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H50O3
InChI InChI=1S/C29H50O3/c1-18(2)8-7-9-19(3)23-10-11-24-22-17-27(32-20(4)30)26-16-21(31)12-14-29(26,6)25(22)13-15-28(23,24)5/h18-19,21-27,31H,7-17H2,1-6H3
InChIKey HSTARSFCWAPQER-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference C.L. Van Antwerp, H. Eggert, C. Djerassi, J. Org. Chem. 42, 789 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3