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A-HOMO-5-ALPHA-CHOLESTAN-3-ONE
SpectraBase Compound ID 82ZVbdteDeq
InChI InChI=1S/C28H48O/c1-19(2)7-6-8-20(3)24-13-14-25-23-12-10-21-9-11-22(29)15-17-27(21,4)26(23)16-18-28(24,25)5/h19-21,23-26H,6-18H2,1-5H3/t20-,21-,23+,24-,25+,26+,27+,28-/m1/s1
InChIKey CPWQVGYAWKUNNL-NXGVQJHJSA-N
Mol Weight 400.7 g/mol
Molecular Formula C28H48O
Exact Mass 400.370516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 25iz5LCF7Oj
Name A-HOMO-5-ALPHA-CHOLESTAN-3-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H48O
InChI InChI=1S/C28H48O/c1-19(2)7-6-8-20(3)24-13-14-25-23-12-10-21-9-11-22(29)15-17-27(21,4)26(23)16-18-28(24,25)5/h19-21,23-26H,6-18H2,1-5H3/t20-,21-,23+,24-,25+,26+,27+,28-/m1/s1
InChIKey CPWQVGYAWKUNNL-NXGVQJHJSA-N
Literature Reference Author V.DAVE,J.B.STOTHERS
Literature Reference Citation CAN.J.CHEM.,57,1550(1979)
Literature Reference DOI 10.1139/v79-253
Molecular Weight 400.689 g/mol
Solvent CDCl3
Source File Reference UWED1599