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17-BETA-CYANO-17-ALPHA-HYDROXYANDROST-4-EN-3-ONE
SpectraBase Compound ID Gd8B2G3qAqN
InChI InChI=1S/C20H27NO2/c1-18-8-5-14(22)11-13(18)3-4-15-16(18)6-9-19(2)17(15)7-10-20(19,23)12-21/h11,15-17,23H,3-10H2,1-2H3/t15-,16+,17+,18+,19+,20+/m1/s1
InChIKey JYCSLUASXDFIEL-HLXURNFRSA-N
Mol Weight 313.44 g/mol
Molecular Formula C20H27NO2
Exact Mass 313.204179 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ar1BLNAW2hv
Name 17-BETA-CYANO-17-ALPHA-HYDROXYANDROST-4-EN-3-ONE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27NO2
InChI InChI=1S/C20H27NO2/c1-18-8-5-14(22)11-13(18)3-4-15-16(18)6-9-19(2)17(15)7-10-20(19,23)12-21/h11,15-17,23H,3-10H2,1-2H3/t15-,16+,17+,18+,19+,20+/m1/s1
InChIKey JYCSLUASXDFIEL-HLXURNFRSA-N
Literature Reference Author G.M.CABALLERO,E.G.GROS
Literature Reference Citation MAGN.RES.CHEM.,34,162(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199602)34:2<162::aid-omr834>3.0.co;2-u
Molecular Weight 313.440 g/mol
Solvent CDCl3
Source File Reference UWCP2035