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1-(2-HYDROXY-2-METHOXYCARBONYL-3,3,3-TRIFLUOROPROPYL)-3,3-DIMETHYL-5,6-BENZO-3,4-DIHYDROISOQUINOLINE
SpectraBase Compound ID LDO27MiFf1N
InChI InChI=1S/C20H20F3NO3/c1-18(2)10-15-13-7-5-4-6-12(13)8-9-14(15)16(24-18)11-19(26,17(25)27-3)20(21,22)23/h4-9,26H,10-11H2,1-3H3
InChIKey LFXGTYNDKWTQSP-UHFFFAOYSA-N
Mol Weight 379.38 g/mol
Molecular Formula C20H20F3NO3
Exact Mass 379.139528 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ks9l6MZC1Yk
Name 1-(2-HYDROXY-2-METHOXYCARBONYL-3,3,3-TRIFLUOROPROPYL)-3,3-DIMETHYL-5,6-BENZO-3,4-DIHYDROISOQUINOLINE
Comments SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H20F3NO3
InChI InChI=1S/C20H20F3NO3/c1-18(2)10-15-13-7-5-4-6-12(13)8-9-14(15)16(24-18)11-19(26,17(25)27-3)20(21,22)23/h4-9,26H,10-11H2,1-3H3
InChIKey LFXGTYNDKWTQSP-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.D.SVIRIDOV, N.D.CHKANIKOV, M.V.GALAKHOV, YU.V.SHKLYAEV, B.B.ALEKSANDROV,M.S.GAVRILOV (1990) Izv.Akad.Nauk SSSR(Russ. Lang.): N6, 1405-1410.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6