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9(11),16,(5α)-Pregnadien-3β-ol-20-one acetate

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9(11),16,(5α)-Pregnadien-3β-ol-20-one acetate
SpectraBase Compound ID D2mJ6EJwIXg
InChI InChI=1S/C23H32O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h7,10,16-18,20H,5-6,8-9,11-13H2,1-4H3/t16-,17-,18-,20-,22-,23+/m0/s1
InChIKey GBSGMSKNTLPLQF-FJLDFKITSA-N
Mol Weight 356.5 g/mol
Molecular Formula C23H32O3
Exact Mass 356.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DYgN0tFuyXM
Name 3-BETA-ACETOXY-5-ALPHA-PREGN-9(11),16-DIEN-20-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H32O3
InChI InChI=1S/C23H32O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h7,10,16-18,20H,5-6,8-9,11-13H2,1-4H3/t16-,17-,18-,20-,22-,23+/m0/s1
InChIKey GBSGMSKNTLPLQF-FJLDFKITSA-N
Literature Reference Author J.A.R.GARCIA,F.A.V.NAVARRO,H.T.V.CASTRO
Literature Reference Citation MAGN.RES.CHEM.,32,547(1994)
Literature Reference DOI 10.1002/mrc.1260320909
Molecular Weight 356.505 g/mol
Solvent CDCl3
Source File Reference UWCP875