For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4,4-Dimethyl-vitamin D3

View entire compound with spectra: 1 NMR

4,4-Dimethyl-vitamin D3
SpectraBase Compound ID 1VANJJTAAgm
InChI InChI=1S/C29H48O/c1-20(2)10-8-11-21(3)25-16-17-26-23(12-9-19-29(25,26)7)14-15-24-22(4)13-18-27(30)28(24,5)6/h14-15,20-21,25-27,30H,4,8-13,16-19H2,1-3,5-7H3/b23-14+,24-15+
InChIKey CSBYSVZLWVNZSA-OZEVPFDHSA-N
Mol Weight 412.7 g/mol
Molecular Formula C29H48O
Exact Mass 412.370516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5uAEwc9D0ZA
Name 4,4-Dimethyl-vitamin D3
CAS Registry Number 68245-42-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H48O
InChI InChI=1S/C29H48O/c1-20(2)10-8-11-21(3)25-16-17-26-23(12-9-19-29(25,26)7)14-15-24-22(4)13-18-27(30)28(24,5)6/h14-15,20-21,25-27,30H,4,8-13,16-19H2,1-3,5-7H3/b23-14+,24-15+
InChIKey CSBYSVZLWVNZSA-OZEVPFDHSA-N
Instrument Name Bruker WH-90
Literature Reference E. Berman, N. Friedman, Y. Mazur, J. Am. Chem. Soc. 100, 5626 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3