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HEXAFLUOROACETONE HYDRATE
SpectraBase Compound ID DOuzXs8xAuW
InChI InChI=1S/C3H2F6O2/c4-2(5,6)1(10,11)3(7,8)9/h10-11H
InChIKey AKVXSYUWYXOLMY-UHFFFAOYSA-N
Mol Weight 184.037 g/mol
Molecular Formula C3H2F6O2
Exact Mass 183.995898 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID rIiWIOiceh
Name Hexafluoroacetone sesquihydrate
CAS Registry Number 677-71-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C3H2F6O2
InChI InChI=1S/C3H2F6O2/c4-2(5,6)1(10,11)3(7,8)9/h10-11H
InChIKey AKVXSYUWYXOLMY-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference E. Breitmaier, G. Jung, L. Pohl, Tetrahedron 29, 2485 (1973).
NMR Standard TMS Ext.
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Neat liquid