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(1-S*,3A-R*,7A-S*)-1-HYDROXY-3A,7,7-TRIMETHYL-3-PHENYL-1,3A,4,6,7-HEXAHYDRO-INDEN-5-ONE
SpectraBase Compound ID Dx8ZIIqGaw9
InChI InChI=1S/C18H22O2/c1-17(2)10-13(19)11-18(3)14(9-15(20)16(17)18)12-7-5-4-6-8-12/h4-9,15-16,20H,10-11H2,1-3H3/t15-,16-,18-/m0/s1
InChIKey KVRFCXSMBIMVLQ-BQFCYCMXSA-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 BeWoXJKrijA
Name (1-S*,3A-R*,7A-S*)-1-HYDROXY-3A,7,7-TRIMETHYL-3-PHENYL-1,3A,4,6,7-HEXAHYDRO-INDEN-5-ONE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O2
InChI InChI=1S/C18H22O2/c1-17(2)10-13(19)11-18(3)14(9-15(20)16(17)18)12-7-5-4-6-8-12/h4-9,15-16,20H,10-11H2,1-3H3/t15-,16-,18-/m0/s1
InChIKey KVRFCXSMBIMVLQ-BQFCYCMXSA-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 270.371 g/mol
Sample ID 26907
Solvent CDCl3