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5-ALPHA-CHOLESTANE-4-BETA,5-DIOL
SpectraBase Compound ID HDKyMFSey07
InChI InChI=1S/C27H48O2/c1-18(2)8-6-9-19(3)21-11-12-22-20-13-17-27(29)24(28)10-7-15-26(27,5)23(20)14-16-25(21,22)4/h18-24,28-29H,6-17H2,1-5H3/t19-,20+,21-,22+,23+,24+,25-,26-,27-/m1/s1
InChIKey XHJMYRAEGCTDKQ-UEWDELQXSA-N
Mol Weight 404.7 g/mol
Molecular Formula C27H48O2
Exact Mass 404.365431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BSQlnGc7AY1
Name 5-ALPHA-CHOLESTANE-4-BETA,5-DIOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H48O2
InChI InChI=1S/C27H48O2/c1-18(2)8-6-9-19(3)21-11-12-22-20-13-17-27(29)24(28)10-7-15-26(27,5)23(20)14-16-25(21,22)4/h18-24,28-29H,6-17H2,1-5H3/t19-,20+,21-,22+,23+,24+,25-,26-,27-/m1/s1
InChIKey XHJMYRAEGCTDKQ-UEWDELQXSA-N
Literature Reference Author J.M.COXON,J.R.GIBSON
Literature Reference Citation AUSTR.J.CHEM.,34,1451(1981)
Literature Reference DOI 10.1071/ch9811451
Molecular Weight 404.677 g/mol
Solvent CDCl3
Source File Reference UNIW22725