For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-OXO-4,4,4-TRIFLUOROBUTANOIC ACID, METHYL ESTER, HYDRATE
SpectraBase Compound ID GFAlt8GjaTu
InChI InChI=1S/C5H7F3O4/c1-12-3(9)2-4(10,11)5(6,7)8/h10-11H,2H2,1H3
InChIKey ZHQCSIAPOJWHIA-UHFFFAOYSA-N
Mol Weight 188.1 g/mol
Molecular Formula C5H7F3O4
Exact Mass 188.029643 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Au0NZyCS5Jm
Name 3-OXO-4,4,4-TRIFLUOROBUTANOIC ACID, METHYL ESTER, HYDRATE
Comments C=1M
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H7F3O4
InChI InChI=1S/C5H7F3O4/c1-12-3(9)2-4(10,11)5(6,7)8/h10-11H,2H2,1H3
InChIKey ZHQCSIAPOJWHIA-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference A.N.FOMIN, V.I.SALOUTIN, K.I.PASHKEVICH, D.V.BAZHENOV, YU.K.GRISHIN,YU.A.USTYNYUK (1983) Izv.Akad.Nauk SSSR(Russ. Lang.): N11, 2626-2632.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6