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LANOST-8(9)-EN-3-ONE
SpectraBase Compound ID 5joS25w4CCt
InChI InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h20-22,25H,9-19H2,1-8H3/t21-,22-,25+,28-,29-,30+/m1/s1
InChIKey JVYYINJWLIGZGB-WUELKCQHSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol
Enantiomer InChIKey JVYYINJWLIGZGB-CZQAGITGSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
The semiempirical derivation of 13C nuclear magnetic resonance chemical shifts. Hydrocarbons, alcohols, amines, ketones, and olefins Canadian Journal of Chemistry 1977

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