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5-ALPHA-ETHINYL-4,4A-BETA,5,6,7,8-HEXAHYDRO-5-HYDROXY-4A-(TRIFLUOROMETHYL)-NAPHTHALEN-2-(3H)-ONE
SpectraBase Compound ID 1FAZZxJlMhr
InChI InChI=1S/C13H13F3O2/c1-2-11(18)6-3-4-9-8-10(17)5-7-12(9,11)13(14,15)16/h1,8,18H,3-7H2/t11-,12+/m0/s1
InChIKey MDPMZXQWCOEESV-NWDGAFQWSA-N
Mol Weight 258.24 g/mol
Molecular Formula C13H13F3O2
Exact Mass 258.086764 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AtwYIIfZMIL
Name 5-ALPHA-ETHINYL-4,4A-BETA,5,6,7,8-HEXAHYDRO-5-HYDROXY-4A-(TRIFLUOROMETHYL)-NAPHTHALEN-2-(3H)-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13F3O2
InChI InChI=1S/C13H13F3O2/c1-2-11(18)6-3-4-9-8-10(17)5-7-12(9,11)13(14,15)16/h1,8,18H,3-7H2/t11-,12+/m0/s1
InChIKey MDPMZXQWCOEESV-NWDGAFQWSA-N
Literature Reference Author J.C.BLAZEJEWSKI,J.GUILHEM,F.L.GUYADER
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1913(1997)
Literature Reference DOI 10.1039/a701876b
Solvent CDCl3
Source File Reference UWRU7729