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ERYTHRO-(METHYL 2-HYDROXY-2-METHYL-3-PHENYL-3-FLUOROBUTANOATE)
SpectraBase Compound ID Aei2N6iTf2z
InChI InChI=1S/C12H15FO3/c1-11(13,9-7-5-4-6-8-9)12(2,15)10(14)16-3/h4-8,15H,1-3H3/t11-,12+/m0/s1
InChIKey DDMFONHPQYPOII-NWDGAFQWSA-N
Mol Weight 226.25 g/mol
Molecular Formula C12H15FO3
Exact Mass 226.100523 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8b7Bz33cRDv
Name ERYTHRO-(METHYL 2-HYDROXY-2-METHYL-3-PHENYL-3-FLUOROBUTANOATE)
Comments SCALE INVERTED, STEREODESCRIPTORS ARE RELATIVE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H15FO3
InChI InChI=1S/C12H15FO3/c1-11(13,9-7-5-4-6-8-9)12(2,15)10(14)16-3/h4-8,15H,1-3H3/t11-,12+/m0/s1
InChIKey DDMFONHPQYPOII-NWDGAFQWSA-N
Instrument Name Bruker HX-90
Literature Reference A.I.AYI, M.REMLI, R.CONDOM, R.GUEDJ (1981) J.Fluor.Chem.: v.17, N6, 565-580.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d