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3-BETA-ACETOXY-16-[BIS-(METHYLTHIO)-METHYLENE]-ANDROST-5-EN-17-ONE
SpectraBase Compound ID 8dfo7GfbiIw
InChI InChI=1S/C24H34O3S2/c1-14(25)27-16-8-10-23(2)15(12-16)6-7-17-19(23)9-11-24(3)20(17)13-18(21(24)26)22(28-4)29-5/h6,16-17,19-20H,7-13H2,1-5H3/t16-,17+,19-,20-,23-,24-/m0/s1
InChIKey QKXQQIQRGIXJRE-VHKPHLOKSA-N
Mol Weight 434.7 g/mol
Molecular Formula C24H34O3S2
Exact Mass 434.194937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EfmGPE7vKv7
Name 3-BETA-ACETOXY-16-[BIS-(METHYLTHIO)-METHYLENE]-ANDROST-5-EN-17-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H34O3S2
InChI InChI=1S/C24H34O3S2/c1-14(25)27-16-8-10-23(2)15(12-16)6-7-17-19(23)9-11-24(3)20(17)13-18(21(24)26)22(28-4)29-5/h6,16-17,19-20H,7-13H2,1-5H3/t16-,17+,19-,20-,23-,24-/m0/s1
InChIKey QKXQQIQRGIXJRE-VHKPHLOKSA-N
Literature Reference Author D.G.RIVERA,K.PESEKE,I.JOMARRON,A.MONTERO,R.MOLINA,F.COLL
Literature Reference Citation MOLECULES,8,444(2003)
Literature Reference DOI 10.3390/80500444
Molecular Weight 434.652 g/mol
Solvent CDCl3
Source File Reference UWMS5808