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1-TERT-BUTYL-3-TRIFLUOROACETYLPYRROLE
SpectraBase Compound ID AvLRpryNcwY
InChI InChI=1S/C10H12F3NO/c1-9(2,3)14-5-4-7(6-14)8(15)10(11,12)13/h4-6H,1-3H3
InChIKey OIUNBHOGUYOFBC-UHFFFAOYSA-N
Mol Weight 219.21 g/mol
Molecular Formula C10H12F3NO
Exact Mass 219.087098 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DLSasfRMPmT
Name 1-TERT-BUTYL-3-TRIFLUOROACETYLPYRROLE (ROTAMER MIXTURE)
Comments C-C SINGLE BOND ROTAMERS. SCALE INVERTED;19F-84.6MHZ
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H12F3NO
InChI InChI=1S/C10H12F3NO/c1-9(2,3)14-5-4-7(6-14)8(15)10(11,12)13/h4-6H,1-3H3
InChIKey OIUNBHOGUYOFBC-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference D.D.CHEDVIK, I.A.KLIFF (1984) Khim.Heteroc.Soed.(Russ. Lang.): N5, 579-612.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6