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17-ALPHA-HYDROXY-3-METHOXY-14,17-BETA-PROPANO-14-BETA-ESTRA-1,3,5(10)-TRIEN-17(2)-ONE
SpectraBase Compound ID L3bYks5zkxA
InChI InChI=1S/C22H28O3/c1-20-8-7-18-17-5-4-16(25-2)11-14(17)3-6-19(18)21(20)9-10-22(20,24)13-15(23)12-21/h4-5,11,18-19,24H,3,6-10,12-13H2,1-2H3/t18?,19?,20-,21-,22-/m0/s1
InChIKey RUFZQPBLUHFJPP-PFHORGDFSA-N
Mol Weight 340.46 g/mol
Molecular Formula C22H28O3
Exact Mass 340.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AefRT3mURkO
Name 17-ALPHA-HYDROXY-3-METHOXY-14,17-BETA-PROPANO-14-BETA-ESTRA-1,3,5(10)-TRIEN-17(2)-ONE
Compound Number 57
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O3
InChI InChI=1S/C22H28O3/c1-20-8-7-18-17-5-4-16(25-2)11-14(17)3-6-19(18)21(20)9-10-22(20,24)13-15(23)12-21/h4-5,11,18-19,24H,3,6-10,12-13H2,1-2H3/t18?,19?,20-,21-,22-/m0/s1
InChIKey RUFZQPBLUHFJPP-PFHORGDFSA-N
Literature Reference Author J.R.BULL,C.HOADLEY,P.G.MOUNTFORD,L.M.STEER
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1179(1997)
Literature Reference DOI 10.1039/a606242c
Molecular Weight 340.463 g/mol
Solvent CDCl3
Source File Reference UWRU9844