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17-ALPHA-ETHYNYL-3-BETA-HYDROXY-17-BETA-ACETOXY-ESTR-4-ENE
SpectraBase Compound ID 8zw7ffuQknQ
InChI InChI=1S/C22H30O3/c1-4-22(25-14(2)23)12-10-20-19-7-5-15-13-16(24)6-8-17(15)18(19)9-11-21(20,22)3/h1,13,16-20,24H,5-12H2,2-3H3/t16-,17-,18+,19+,20-,21-,22-/m0/s1
InChIKey WJCWCFAFTXVJQT-KAKDVIIHSA-N
Mol Weight 342.48 g/mol
Molecular Formula C22H30O3
Exact Mass 342.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BE2NN7O6DVO
Name 17-ALPHA-ETHYNYL-3-BETA-HYDROXY-17-BETA-ACETOXY-ESTR-4-ENE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O3
InChI InChI=1S/C22H30O3/c1-4-22(25-14(2)23)12-10-20-19-7-5-15-13-16(24)6-8-17(15)18(19)9-11-21(20,22)3/h1,13,16-20,24H,5-12H2,2-3H3/t16-,17-,18+,19+,20-,21-,22-/m0/s1
InChIKey WJCWCFAFTXVJQT-KAKDVIIHSA-N
Literature Reference Author S.ZAFAR,S.YOUSUF,H.A.KAYANI,S.SAIFULLAH,S.KHAN,A.M.AL-MAJID, M.I.CHOUDHARY
Literature Reference Citation CHEM.CENTR.J.,6,109,1(2012)
Molecular Weight 342.478 g/mol
Solvent CDCl3
Source File Reference UWIR11716