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2,6-ditert-butyl-4-ethynyl-4-hydroxycyclohexa-2,5-dien-1-one

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2,6-ditert-butyl-4-ethynyl-4-hydroxycyclohexa-2,5-dien-1-one
SpectraBase Compound ID 9S7NSJTcCd3
InChI InChI=1S/C16H22O2/c1-8-16(18)9-11(14(2,3)4)13(17)12(10-16)15(5,6)7/h1,9-10,18H,2-7H3
InChIKey NIPJNPXNUWRDKZ-UHFFFAOYSA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ElxQVENHAtS
Name 2,6-ditert-butyl-4-ethynyl-4-hydroxycyclohexa-2,5-dien-1-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-8-16(18)9-11(14(2,3)4)13(17)12(10-16)15(5,6)7/h1,9-10,18H,2-7H3
InChIKey NIPJNPXNUWRDKZ-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2008)
Molecular Weight 246.349 g/mol
Source File Reference MHKO18022