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(1R,2R,3R,6S)-4-HYDROXY-4,7,7-TRIMETHYL-BICYCLO-[4.1.0]-HEPT-3-YL-(2S)-2-FLUORO-2-[4-(2-METHYLPROPYL)-PHENYL]-PROPIONATE
SpectraBase Compound ID E2BL19jJ0C4
InChI InChI=1S/C23H33FO3/c1-14(2)11-15-7-9-16(10-8-15)23(6,24)20(25)27-19-12-17-18(21(17,3)4)13-22(19,5)26/h7-10,14,17-19,26H,11-13H2,1-6H3/t17-,18+,19-,22-,23+/m1/s1
InChIKey ISHHFSFUNUWECI-LYHQQNOOSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H33FO3
Exact Mass 376.241373 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BS957wXgJPB
Name (1R,2R,3R,6S)-4-HYDROXY-4,7,7-TRIMETHYL-BICYCLO-[4.1.0]-HEPT-3-YL-(2S)-2-FLUORO-2-[4-(2-METHYLPROPYL)-PHENYL]-PROPIONATE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H33FO3
InChI InChI=1S/C23H33FO3/c1-14(2)11-15-7-9-16(10-8-15)23(6,24)20(25)27-19-12-17-18(21(17,3)4)13-22(19,5)26/h7-10,14,17-19,26H,11-13H2,1-6H3/t17-,18+,19-,22-,23+/m1/s1
InChIKey ISHHFSFUNUWECI-LYHQQNOOSA-N
Literature Reference Author H.FUJISAWA,T.FUJIWARA,Y.TAKEUCHI,K.OMATA
Literature Reference Citation CHEM.PHARM.BULL.,53,524(2005)
Literature Reference DOI 10.1248/cpb.53.524
Solvent CDCl3
Source File Reference UWLU54008