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1,3-Benzenedimethanol, 2-bromo-5-(1,1-dimethylethyl)-.alpha.,.alpha.,.alpha.',.alpha.'-tetrakis(trifluoromethyl)-

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1,3-Benzenedimethanol, 2-bromo-5-(1,1-dimethylethyl)-.alpha.,.alpha.,.alpha.',.alpha.'-tetrakis(trifluoromethyl)-
SpectraBase Compound ID E6Nt8ZipJ2Y
InChI InChI=1S/C16H13BrF12O2/c1-10(2,3)6-4-7(11(30,13(18,19)20)14(21,22)23)9(17)8(5-6)12(31,15(24,25)26)16(27,28)29/h4-5,30-31H,1-3H3
InChIKey RCCUEAROWLLEDQ-UHFFFAOYSA-N
Mol Weight 545.16 g/mol
Molecular Formula C16H13BrF12O2
Exact Mass 543.990731 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5K8ljgZtIRr
Name 4-tert-Butyl-2,6-bis(1-hydroxy-1-trifluoromethyl-2,2,2-trifluoro-ethyl)-bromo-benzene
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H13BrF12O2
InChI InChI=1S/C16H13BrF12O2/c1-10(2,3)6-4-7(11(30,13(18,19)20)14(21,22)23)9(17)8(5-6)12(31,15(24,25)26)16(27,28)29/h4-5,30-31H,1-3H3
InChIKey RCCUEAROWLLEDQ-UHFFFAOYSA-N
Literature Reference T.T. Nguyen, S.R. Wilson, J.C.Martin, J. Am. Chem. Soc. 108, 3803 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3