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5-ALPHA-ERGOSTA-7,9(11),22-TRIEN-3-BETA-OL
SpectraBase Compound ID B9I1Vz8IoCA
InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,10,14,18-22,24-25,29H,9,11-13,15-17H2,1-6H3/b8-7+/t19?,20-,21+,22+,24-,25+,27+,28-/m1/s1
InChIKey XSMGJKKUFBTARU-RLASYAHHSA-N
Mol Weight 396.7 g/mol
Molecular Formula C28H44O
Exact Mass 396.339216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H1E0oQQ4PEg
Name 5-ALPHA-ERGOSTA-7,9(11),22-TRIEN-3-BETA-OL
Compound Number 278
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H44O
InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,10,14,18-22,24-25,29H,9,11-13,15-17H2,1-6H3/b8-7+/t19?,20-,21+,22+,24-,25+,27+,28-/m1/s1
InChIKey XSMGJKKUFBTARU-RLASYAHHSA-N
Literature Reference Author J.W.BLUNT,J.B.STOTHERS
Literature Reference Citation ORG.MAGN.RES.,9,439(1977)
Literature Reference DOI 10.1002/mrc.1270090802
Molecular Weight 396.657 g/mol
Solvent CHCl3
Source File Reference UNIW3441