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2-HYDROXY-CHOLEST-1,4-DIEN-3-ONE

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2-HYDROXY-CHOLEST-1,4-DIEN-3-ONE
SpectraBase Compound ID 5a4lXB7udyZ
InChI InChI=1S/C27H42O2/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-24(28)25(29)16-27(19,5)23(20)13-14-26(21,22)4/h15-18,20-23,29H,6-14H2,1-5H3/t18-,20+,21-,22+,23+,26-,27+/m1/s1
InChIKey UEPOBLMKSBKKPE-MULSQHAESA-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 1iG1R4QG4TN
Name 2-HYDROXY-CHOLEST-1,4-DIEN-3-ONE
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)21-11-12-22-20-10-9-19-15-24(28)25(29)16-27(19,5)23(20)13-14-26(21,22)4/h15-18,20-23,29H,6-14H2,1-5H3/t18-,20+,21-,22+,23+,26-,27+/m1/s1
InChIKey UEPOBLMKSBKKPE-MULSQHAESA-N
Literature Reference Author A.A.FRIMER,J.HAMEIRI-BUCH,S.RIPSHTOS,P.GILINSKY-SHARON
Literature Reference Citation TETRAHEDRON,42,5693(1986)
Literature Reference DOI 10.1016/S0040-4020(01)88175-8
Molecular Weight 398.629 g/mol
Solvent CDCl3
Source File Reference UWBK1266