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5-ALPHA-CHOLESTAN-1-ALPHA,3-ALPHA-DIOL
SpectraBase Compound ID JV3emfxJp9y
InChI InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)16-25(29)27(19,5)24(21)13-14-26(22,23)4/h17-25,28-29H,6-16H2,1-5H3/t18-,19+,20+,21+,22-,23+,24+,25+,26-,27+/m1/s1
InChIKey QKKCBCJYKCUZIS-OVZDLBISSA-N
Mol Weight 404.7 g/mol
Molecular Formula C27H48O2
Exact Mass 404.365431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J6xNsxvwpNf
Name 5-ALPHA-CHOLESTAN-1-ALPHA,3-ALPHA-DIOL
CAS Registry Number 571-01-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H48O2
InChI InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)16-25(29)27(19,5)24(21)13-14-26(22,23)4/h17-25,28-29H,6-16H2,1-5H3/t18-,19+,20+,21+,22-,23+,24+,25+,26-,27+/m1/s1
InChIKey QKKCBCJYKCUZIS-OVZDLBISSA-N
Literature Reference Author C.L.VANANTWERP,H.EGGERT,G.D.MEAKINS,J.O.MINERS,C.DJERASSI
Literature Reference Citation J.ORG.CHEM.,42,789(1977)
Literature Reference DOI 10.1021/jo00425a005
Molecular Weight 404.677 g/mol
Solvent CDCl3
Source File Reference UNIW9691