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Des-A-vitamin D3

View entire compound with spectra: 1 NMR

Des-A-vitamin D3
SpectraBase Compound ID JRWneRbMcon
InChI InChI=1S/C21H36/c1-6-9-18-12-8-15-21(5)19(13-14-20(18)21)17(4)11-7-10-16(2)3/h6,9,16-17,19-20H,1,7-8,10-15H2,2-5H3/b18-9+
InChIKey KLGVYPNMJKHRSL-GIJQJNRQSA-N
Mol Weight 288.5 g/mol
Molecular Formula C21H36
Exact Mass 288.281701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BO5rLm4MuP9
Name Des-A-vitamin D3
CAS Registry Number 84928-47-2
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C21H36
InChI InChI=1S/C21H36/c1-6-9-18-12-8-15-21(5)19(13-14-20(18)21)17(4)11-7-10-16(2)3/h6,9,16-17,19-20H,1,7-8,10-15H2,2-5H3/b18-9+
InChIKey KLGVYPNMJKHRSL-GIJQJNRQSA-N
Instrument Name Bruker WH-270
Literature Reference M. Duraisamy, H.M. Walborsky, J. Am. Chem. Soc. 105, 3270 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3