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7-DEHYDROCHOLESTERYL-ACETATE;3-BETA-ACETOXY-CHOLESTA-5,7-DIENE
SpectraBase Compound ID EuokZVrEwCj
InChI InChI=1S/C29H46O2/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/h10-11,19-20,23,25-27H,7-9,12-18H2,1-6H3/t20-,23+,25-,26+,27+,28+,29-/m1/s1
InChIKey ACGNVBRAISEVDK-RPIQFHTISA-N
Mol Weight 426.7 g/mol
Molecular Formula C29H46O2
Exact Mass 426.349781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JRnZyMctY7q
Name 7-DEHYDROCHOLESTERYL-ACETATE;3-BETA-ACETOXY-CHOLESTA-5,7-DIENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H46O2
InChI InChI=1S/C29H46O2/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/h10-11,19-20,23,25-27H,7-9,12-18H2,1-6H3/t20-,23+,25-,26+,27+,28+,29-/m1/s1
InChIKey ACGNVBRAISEVDK-RPIQFHTISA-N
Literature Reference Author R.E.PERRIER,M.J.MCGLINCHEY
Literature Reference Citation CAN.J.CHEM.,66,3003(1988)
Literature Reference DOI 10.1139/v88-466
Molecular Weight 426.683 g/mol
Solvent CDCl3
Source File Reference UWCS7931