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2-FLUORO-N-METHYL-N-[[(3S,4S)-4-[2-(TRIFLUOROMETHYL)-PHENOXY]-3,4-DIHYDRO-1H-ISOCHROMEN-3-YL]-METHYL]-ETHANAMINE
SpectraBase Compound ID 8VvE7R3iKpH
InChI InChI=1S/C20H21F4NO2/c1-25(11-10-21)12-18-19(15-7-3-2-6-14(15)13-26-18)27-17-9-5-4-8-16(17)20(22,23)24/h2-9,18-19H,10-13H2,1H3/t18-,19-/m0/s1
InChIKey JLCNYDRJTJZGKY-OALUTQOASA-N
Mol Weight 383.39 g/mol
Molecular Formula C20H21F4NO2
Exact Mass 383.150842 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 47fBDJJJO2J
Name 2-FLUORO-N-METHYL-N-[[(3S,4S)-4-[2-(TRIFLUOROMETHYL)-PHENOXY]-3,4-DIHYDRO-1H-ISOCHROMEN-3-YL]-METHYL]-ETHANAMINE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21F4NO2
InChI InChI=1S/C20H21F4NO2/c1-25(11-10-21)12-18-19(15-7-3-2-6-14(15)13-26-18)27-17-9-5-4-8-16(17)20(22,23)24/h2-9,18-19H,10-13H2,1H3/t18-,19-/m0/s1
InChIKey JLCNYDRJTJZGKY-OALUTQOASA-N
Literature Reference Author C.NEUDORFER,K.SHANAB,W.HOLZER,C.RAMI-MARK,M.MITTERHAUSER,W.W ADSAK,H.SPREITZER
Literature Reference Citation MOLBANK,M858(2015)
Molecular Weight 383.386 g/mol
Solvent CDCl3
Source File Reference UWLU83010