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(3AS,4R,7S,7AR)-2-(TRIFLUOROMETHYL)-3-UNDECYL-3A,4,5,6,7,7A-HEXAHYDRO-1H-4,7-METHANOINDEN-1-ONE
SpectraBase Compound ID 8Zar4MAwDOO
InChI InChI=1S/C22H33F3O/c1-2-3-4-5-6-7-8-9-10-11-17-18-15-12-13-16(14-15)19(18)21(26)20(17)22(23,24)25/h15-16,18-19H,2-14H2,1H3/t15-,16+,18-,19-/m0/s1
InChIKey JJMPPIDYOPVCOD-NBMJBFSESA-N
Mol Weight 370.5 g/mol
Molecular Formula C22H33F3O
Exact Mass 370.24835 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1PZF61hd0mK
Name (3AS,4R,7S,7AR)-2-(TRIFLUOROMETHYL)-3-UNDECYL-3A,4,5,6,7,7A-HEXAHYDRO-1H-4,7-METHANOINDEN-1-ONE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H33F3O
InChI InChI=1S/C22H33F3O/c1-2-3-4-5-6-7-8-9-10-11-17-18-15-12-13-16(14-15)19(18)21(26)20(17)22(23,24)25/h15-16,18-19H,2-14H2,1H3/t15-,16+,18-,19-/m0/s1
InChIKey JJMPPIDYOPVCOD-NBMJBFSESA-N
Literature Reference Author N.AIGUABELLA,E.M.ARCE,C.D.POZO,X.VERDAGUER,A.RIERA
Literature Reference Citation MOLECULES,19,1763(2014)
Literature Reference DOI 10.3390/molecules19021763
Solvent CDCl3
Source File Reference UWBT14842