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11-DEOXY-16-(META-TRIFLUOROMETHYLPHENOXY)-PROSTAGLANDIN PGE1 ETHYLESTER
SpectraBase Compound ID 4zdCB8ZiqIa
InChI InChI=1S/C25H33F3O5/c1-2-32-24(31)11-6-4-3-5-10-22-18(13-15-23(22)30)12-14-20(29)17-33-21-9-7-8-19(16-21)25(26,27)28/h7-9,12,14,16,18,20,22,29H,2-6,10-11,13,15,17H2,1H3/b14-12+/t18-,20+,22+/m1/s1
InChIKey NOJVIYBMEWMROX-YNQAWFKZSA-N
Mol Weight 470.5 g/mol
Molecular Formula C25H33F3O5
Exact Mass 470.228009 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2JezqWDVlW2
Name 11-DEOXY-16-(META-TRIFLUOROMETHYLPHENOXY)-PROSTAGLANDIN PGE1 ETHYLESTER
Comments =
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Formula C25H33F3O5
InChI InChI=1S/C25H33F3O5/c1-2-32-24(31)11-6-4-3-5-10-22-18(13-15-23(22)30)12-14-20(29)17-33-21-9-7-8-19(16-21)25(26,27)28/h7-9,12,14,16,18,20,22,29H,2-6,10-11,13,15,17H2,1H3/b14-12+/t18-,20+,22+/m1/s1
InChIKey NOJVIYBMEWMROX-YNQAWFKZSA-N
Instrument Name Bruker WH-90
Literature Reference T.VALIMAE, T.PEHK, E.LIPPMAA, M.LOPP, U.LILLE (1986) Izv.Akad.Nauk Estonii,Khim.(Russ. Lang.): v.35, N3, 165-192.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d