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METHYL 2-(ALPHA-METHYLBENZYLAMINO)-3,3,3-TRIFLUOROPROPANOATE
SpectraBase Compound ID HVOEMvnrnxK
InChI InChI=1S/C12H14F3NO2/c1-8(9-6-4-3-5-7-9)16-10(11(17)18-2)12(13,14)15/h3-8,10,16H,1-2H3
InChIKey OMLGLLPHIYZHNI-UHFFFAOYSA-N
Mol Weight 261.24 g/mol
Molecular Formula C12H14F3NO2
Exact Mass 261.097663 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8tj447ncGEs
Name METHYL 2-(ALPHA-METHYLBENZYLAMINO)-3,3,3-TRIFLUOROPROPANOATE
Comments DIASTEREOMER 2. SCALE INVERTED;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H14F3NO2
InChI InChI=1S/C12H14F3NO2/c1-8(9-6-4-3-5-7-9)16-10(11(17)18-2)12(13,14)15/h3-8,10,16H,1-2H3
InChIKey OMLGLLPHIYZHNI-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.A.SOLOSHONOK, YU.L.YAGUPOL'SKY, V.P.KUKHAR' (1988) Zhurn.Org.Khim.(Russ.Lang.): v.24, N8, 1638-1644.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d