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(1-S*,2-R*,3-S*,3A-R*,7A-S*)-2,3-EPOXY-1-HYDROXY-3A,7,7-TRIMETHYL-3-PHENYL-PERHYDRO-INDEN-5-ONE
SpectraBase Compound ID DJEUsINga57
InChI InChI=1S/C18H22O3/c1-16(2)9-12(19)10-17(3)14(16)13(20)15-18(17,21-15)11-7-5-4-6-8-11/h4-8,13-15,20H,9-10H2,1-3H3/t13-,14-,15+,17+,18+/m0/s1
InChIKey YIFMKTAYQZYSBA-KCEFYPGHSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JaWgjnQjpYU
Name (1-S*,2-R*,3-S*,3A-R*,7A-S*)-2,3-EPOXY-1-HYDROXY-3A,7,7-TRIMETHYL-3-PHENYL-PERHYDRO-INDEN-5-ONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-16(2)9-12(19)10-17(3)14(16)13(20)15-18(17,21-15)11-7-5-4-6-8-11/h4-8,13-15,20H,9-10H2,1-3H3/t13-,14-,15+,17+,18+/m0/s1
InChIKey YIFMKTAYQZYSBA-KCEFYPGHSA-N
Literature Reference Author A.FERNANDEZ-MATEOS,E.M.M.DELANAVA,G.P.COCA,R.R.GONZALEZ,A.I. R.SILVO,M.S.J.SIMMON
Literature Reference Citation J.ORG.CHEM.,63,9440(1998)
Literature Reference DOI 10.1021/jo981456q
Molecular Weight 286.371 g/mol
Sample ID 26910
Solvent CDCl3