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Cholest-4-ene-3,6-dione
SpectraBase Compound ID CK7AueTEOiQ
InChI InChI=1S/C27H42O2/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/h15,17-18,20-23H,6-14,16H2,1-5H3/t18-,20-,21-,22+,23+,26-,27-/m1/s1
InChIKey GWOSBUGZGFVDDS-ARGLXUBUSA-N
Mol Weight 398.6 g/mol
Molecular Formula C27H42O2
Exact Mass 398.318481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FluO8NfoVGs
Name CHOLEST-4-ENE-3,6-DIONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H42O2
InChI InChI=1S/C27H42O2/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/h15,17-18,20-23H,6-14,16H2,1-5H3/t18-,20-,21-,22+,23+,26-,27-/m1/s1
InChIKey GWOSBUGZGFVDDS-ARGLXUBUSA-N
Literature Reference Author A.AIELLO,E.FATTORUSSO,S.MAGNO,M.MENNA,M.PANSINI
Literature Reference Citation J.NAT.PROD.,54,281(1991)
Literature Reference DOI 10.1021/np50073a035
Molecular Weight 398.629 g/mol
Solvent C6D6
Source File Reference UWCS5324