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CHOLEST-5-EN-3-OL, ACETATE

View entire compound with spectra: 21 NMR, and 12 MS (GC)

CHOLEST-5-EN-3-OL, ACETATE
SpectraBase Compound ID 8Yu7T9kjm5p
InChI InChI=1S/C29H48O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-20,23-27H,7-9,11-18H2,1-6H3
InChIKey XUGISPSHIFXEHZ-UHFFFAOYSA-N
Mol Weight 428.7 g/mol
Molecular Formula C29H48O2
Exact Mass 428.365431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4CoVDpUmBPx
Name Cholesteryl acetate
CAS Registry Number 604-35-3
Comments CONFIGURATION S AT C20
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H48O2
InChI InChI=1S/C29H48O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-20,23-27H,7-9,11-18H2,1-6H3
InChIKey XUGISPSHIFXEHZ-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference W. Sucrow, M. Van Nooy, Liebigs Ann. Chem. 1897 (1982).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3