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5-ALPHA-CHOLESTAN-2-ONE
SpectraBase Compound ID Je2uWcXYPq5
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-13-14-24-22-12-10-20-9-11-21(28)17-27(20,5)25(22)15-16-26(23,24)4/h18-20,22-25H,6-17H2,1-5H3/t19-,20-,22+,23-,24+,25+,26-,27+/m1/s1
InChIKey RHEVDIMHCWCAIX-JCVJIKLGSA-N
Mol Weight 386.7 g/mol
Molecular Formula C27H46O
Exact Mass 386.354866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FybToXvJhp9
Name 5-ALPHA-CHOLESTAN-2-ONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H46O
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-13-14-24-22-12-10-20-9-11-21(28)17-27(20,5)25(22)15-16-26(23,24)4/h18-20,22-25H,6-17H2,1-5H3/t19-,20-,22+,23-,24+,25+,26-,27+/m1/s1
InChIKey RHEVDIMHCWCAIX-JCVJIKLGSA-N
Literature Reference Author V.DAVE,J.B.STOTHERS,E.W.WARNHOFF
Literature Reference Citation CAN.J.CHEM.,62,1965(1984)
Literature Reference DOI 10.1139/v84-337
Molecular Weight 386.662 g/mol
Solvent CDCl3
Source File Reference UWED2111