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Hexestrol
SpectraBase Compound ID AwBJRvlwfqc
InChI InChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3
InChIKey PBBGSZCBWVPOOL-UHFFFAOYSA-N
Mol Weight 270.37 g/mol
Molecular Formula C18H22O2
Exact Mass 270.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EcRy5AxEpiV
Name (R,S)-3,4-BIS-(4-HYDROXYPHENYL)-HEXANE;MESO-HEXESTROL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O2
InChI InChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3
InChIKey PBBGSZCBWVPOOL-UHFFFAOYSA-N
Literature Reference Author M.J.KOCHANNY,T.HAERD,J.A.KATZENELLENBOGEN
Literature Reference Citation MAGN.RES.CHEM.,31,977(1993)
Literature Reference DOI 10.1002/mrc.1260311105
Molecular Weight 270.371 g/mol
Solvent CD3OD
Source File Reference UWVP511