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5-ALPHA-CHOLESTANE-3,6-DIONE
SpectraBase Compound ID JRMPOo5fQ8w
InChI InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-18,20-24H,6-16H2,1-5H3/t18-,20+,21-,22+,23+,24-,26-,27-/m1/s1
InChIKey LNGLEOIUQBVRRY-PWNVBJGISA-N
Mol Weight 400.6 g/mol
Molecular Formula C27H44O2
Exact Mass 400.334131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4BVkXjxiFj6
Name 5-ALPHA-CHOLESTANE-3,6-DIONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44O2
InChI InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-18,20-24H,6-16H2,1-5H3/t18-,20+,21-,22+,23+,24-,26-,27-/m1/s1
InChIKey LNGLEOIUQBVRRY-PWNVBJGISA-N
Literature Reference Author J.P.STARCK,A.MILON,Y.NAKATANI,G.OURISSON
Literature Reference Citation BULL.SOC.CHIM.FR.,131,210(1994)
Molecular Weight 400.645 g/mol
Solvent CDCl3
Source File Reference UWSK2457