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4,6-ditert-butyl-3-chloro-o-benzoquinone

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4,6-ditert-butyl-3-chloro-o-benzoquinone
SpectraBase Compound ID 3GJ9s62P0TH
InChI InChI=1S/C14H19ClO2/c1-13(2,3)8-7-9(14(4,5)6)11(16)12(17)10(8)15/h7H,1-6H3
InChIKey ZKRLBHOGMYNZBH-UHFFFAOYSA-N
Mol Weight 254.76 g/mol
Molecular Formula C14H19ClO2
Exact Mass 254.107358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AAw3F7uhERt
Name 3-Chloro-4,6-di-tert-butyl-O-benzoquinone
CAS Registry Number 37780-09-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H19ClO2
InChI InChI=1S/C14H19ClO2/c1-13(2,3)8-7-9(14(4,5)6)11(16)12(17)10(8)15/h7H,1-6H3
InChIKey ZKRLBHOGMYNZBH-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference S. Berger, A. Rieker, Tetrahedron 28, 3123 (1972).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3