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alpha,alpha,alpha',alpha'-Tetrakis(trifluoromethyl)-1,4-benzenedimethanol hydrate
SpectraBase Compound ID Dktk5GHlsAs
InChI InChI=1S/C12H6F12O2.O/c13-9(14,15)7(25,10(16,17)18)5-1-2-6(4-3-5)8(26,11(19,20)21)12(22,23)24;/h1-4,25-26H;
InChIKey KHZWBOMEBVOYBJ-UHFFFAOYSA-N
Mol Weight 426.158 g/mol
Molecular Formula C12H6F12O3
Exact Mass 426.012532 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H1N8mb7bC2i
Name alpha,alpha,alpha',alpha'-Tetrakis(trifluoromethyl)-1,4-benzenedimethanol hydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 386642
CAS Registry Number 304851-82-9
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6F12O3
InChI InChI=1S/C12H6F12O2.O/c13-9(14,15)7(25,10(16,17)18)5-1-2-6(4-3-5)8(26,11(19,20)21)12(22,23)24;/h1-4,25-26H;
InChIKey KHZWBOMEBVOYBJ-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_008430