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(4aS)-6-hydroxy-7-isopropyl-1,1,4a-trimethyl-3,4,10,10a-tetrahydrophenanthrene-2,9-quinone
SpectraBase Compound ID EKPqMjHvEEJ
InChI InChI=1S/C20H26O3/c1-11(2)12-8-13-14(9-15(12)21)20(5)7-6-18(23)19(3,4)17(20)10-16(13)22/h8-9,11,17,21H,6-7,10H2,1-5H3/t17?,20-/m1/s1
InChIKey VWUIHEHESVHLRX-UUSAFJCLSA-N
Mol Weight 314.43 g/mol
Molecular Formula C20H26O3
Exact Mass 314.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EpV2e1RpXnd
Name (4aS)-6-hydroxy-7-isopropyl-1,1,4a-trimethyl-3,4,10,10a-tetrahydrophenanthrene-2,9-quinone
Compound Number 67
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26O3
InChI InChI=1S/C20H26O3/c1-11(2)12-8-13-14(9-15(12)21)20(5)7-6-18(23)19(3,4)17(20)10-16(13)22/h8-9,11,17,21H,6-7,10H2,1-5H3/t17?,20-/m1/s1
InChIKey VWUIHEHESVHLRX-UUSAFJCLSA-N
Literature Reference Author J.M.M.DELCORRAL,M.GORDALIZA,M.A.SALINERO,A.SANFELICIANO
Literature Reference Citation MAGN.RES.CHEM.,32,774(1994)
Literature Reference DOI 10.1002/mrc.1260321211
Molecular Weight 314.425 g/mol
Solvent CDCl3
Source File Reference UWGE224