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DEUTEROHEXAFLUOROACETONSESQUIHYDRAT
SpectraBase Compound ID C9A4OZ5y9sP
InChI InChI=1S/C3H2F6O2/c4-2(5,6)1(10,11)3(7,8)9/h10-11H/i10D,11D
InChIKey AKVXSYUWYXOLMY-MIBQVNFTSA-N
Mol Weight 186.05 g/mol
Molecular Formula C3D2F6O2
Exact Mass 186.008452 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jb6RR8KXrA7
Name Hexafluoroacetone dideuterio-sesquihydrate
CAS Registry Number 51219-87-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C3D2F6O2
InChI InChI=1S/C3H2F6O2/c4-2(5,6)1(10,11)3(7,8)9/h10-11H/i10D,11D
InChIKey AKVXSYUWYXOLMY-MIBQVNFTSA-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