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3-OXA-A-HOMO-5-ALPHA-CHOLESTAN-2-ONE

View entire compound with spectra: 1 NMR

3-OXA-A-HOMO-5-ALPHA-CHOLESTAN-2-ONE
SpectraBase Compound ID E4DI6i3SaNB
InChI InChI=1S/C27H46O2/c1-18(2)7-6-8-19(3)22-11-12-23-21-10-9-20-14-16-29-25(28)17-27(20,5)24(21)13-15-26(22,23)4/h18-24H,6-17H2,1-5H3/t19-,20+,21+,22-,23+,24+,26-,27+/m1/s1
InChIKey YOZMQULPDQVWPF-XLDSYAJBSA-N
Mol Weight 402.7 g/mol
Molecular Formula C27H46O2
Exact Mass 402.349781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1IuY32batW1
Name 3-OXA-A-HOMO-5-ALPHA-CHOLESTAN-2-ONE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H46O2
InChI InChI=1S/C27H46O2/c1-18(2)7-6-8-19(3)22-11-12-23-21-10-9-20-14-16-29-25(28)17-27(20,5)24(21)13-15-26(22,23)4/h18-24H,6-17H2,1-5H3/t19-,20+,21+,22-,23+,24+,26-,27+/m1/s1
InChIKey YOZMQULPDQVWPF-XLDSYAJBSA-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 402.661 g/mol
Solvent CDCl3
Source File Reference UWED2117