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(+/-)-2-TERT.-BUTYL-3,17-BETA-DIHYDROXY-6-OXAESTRA-1,3,5(10),8(9)-TETRAEN-7-ONE
SpectraBase Compound ID 3k7XrBy2NrH
InChI InChI=1S/C21H26O4/c1-20(2,3)14-9-12-11-7-8-21(4)13(5-6-17(21)23)18(11)19(24)25-16(12)10-15(14)22/h9-10,13,17,22-23H,5-8H2,1-4H3/t13?,17-,21-/m0/s1
InChIKey QHPRVXYJBWTEGX-WTWGDYNRSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 542sIO8jSvH
Name (+/-)-2-TERT.-BUTYL-3,17-BETA-DIHYDROXY-6-OXAESTRA-1,3,5(10),8(9)-TETRAEN-7-ONE
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O4
InChI InChI=1S/C21H26O4/c1-20(2,3)14-9-12-11-7-8-21(4)13(5-6-17(21)23)18(11)19(24)25-16(12)10-15(14)22/h9-10,13,17,22-23H,5-8H2,1-4H3/t13?,17-,21-/m0/s1
InChIKey QHPRVXYJBWTEGX-WTWGDYNRSA-N
Literature Reference Author D.J.COLLINS,A.G.JHINGRAN,S.B.RUTSCHMANN
Literature Reference Citation AUSTR.J.CHEM.,42,1769(1989)
Literature Reference DOI 10.1071/ch9891769
Molecular Weight 342.435 g/mol
Solvent DMSO-D6
Source File Reference UWRU8710