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5-ALPHA-CHOLESTAN-7-ALPHA-YL-ACETATE
SpectraBase Compound ID 8qON0xtUDqr
InChI InChI=1S/C29H50O2/c1-19(2)10-9-11-20(3)23-13-14-24-27-25(15-17-29(23,24)6)28(5)16-8-7-12-22(28)18-26(27)31-21(4)30/h19-20,22-27H,7-18H2,1-6H3/t20-,22-,23-,24+,25+,26-,27+,28+,29-/m1/s1
InChIKey MRVPOLGRRKLUQS-JFVAMVLKSA-N
Mol Weight 430.7 g/mol
Molecular Formula C29H50O2
Exact Mass 430.381081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J4k7OaxujtY
Name 7-ALPHA-ACETOXYCHOLESTANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H50O2
InChI InChI=1S/C29H50O2/c1-19(2)10-9-11-20(3)23-13-14-24-27-25(15-17-29(23,24)6)28(5)16-8-7-12-22(28)18-26(27)31-21(4)30/h19-20,22-27H,7-18H2,1-6H3/t20-,22-,23-,24+,25+,26-,27+,28+,29-/m1/s1
InChIKey MRVPOLGRRKLUQS-JFVAMVLKSA-N
Literature Reference Author H.EGGERT,C.L.VANANTWERP,N.S.BHACCA,C.DJERASSI
Literature Reference Citation J.ORG.CHEM.,41,71(1976)
Literature Reference DOI 10.1021/jo00863a016
Molecular Weight 430.715 g/mol
Solvent CDCl3
Source File Reference UNIW8866