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3-(1,1,1-TRIFLUOROPROP-2-YL)-2,6,6-TRIMETHYL-1-PHENYLHEPTANE-1,5-DIONE;MAJOR-ISOMER
SpectraBase Compound ID CeVsceRgpMW
InChI InChI=1S/C19H25F3O2/c1-12(17(24)14-9-7-6-8-10-14)15(13(2)19(20,21)22)11-16(23)18(3,4)5/h6-10,12-13,15H,11H2,1-5H3/t12?,13-,15?/m0/s1
InChIKey JRGOJLMYERZPIH-OWYJLGKBSA-N
Mol Weight 342.4 g/mol
Molecular Formula C19H25F3O2
Exact Mass 342.180665 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5EymsjVYpxT
Name 3-(1,1,1-TRIFLUOROPROP-2-YL)-2,6,6-TRIMETHYL-1-PHENYLHEPTANE-1,5-DIONE;MINOR-ISOMER
Compound Number 11C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H25F3O2
InChI InChI=1S/C19H25F3O2/c1-12(17(24)14-9-7-6-8-10-14)15(13(2)19(20,21)22)11-16(23)18(3,4)5/h6-10,12-13,15H,11H2,1-5H3/t12?,13-,15?/m0/s1
InChIKey JRGOJLMYERZPIH-OWYJLGKBSA-N
Literature Reference Author T.YAMAZAKI,T.ICHIGE,S.TAKEI,S.KAWASHITA,T.KITAZUME,T.KUBOTA
Literature Reference Citation ORG.LETTERS,3,2915(2001)
Literature Reference DOI 10.1021/ol016401g
Solvent CDCl3
Source File Reference UWVN30784