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4,4'-(1,4-PHENYLENE)-BIS-[2,6-BIS-(TERT.-BUTYL)-4-HYDROXYCYCLOHEXA-2,5-DIENE-1-ONE]
SpectraBase Compound ID HLery6oItrj
InChI InChI=1S/C34H46O4/c1-29(2,3)23-17-33(37,18-24(27(23)35)30(4,5)6)21-13-15-22(16-14-21)34(38)19-25(31(7,8)9)28(36)26(20-34)32(10,11)12/h13-20,37-38H,1-12H3
InChIKey NYMYVEAUUOYHMK-UHFFFAOYSA-N
Mol Weight 518.7 g/mol
Molecular Formula C34H46O4
Exact Mass 518.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7HVeAGb0tdz
Name 4,4'-(1,4-PHENYLENE)-BIS-[2,6-BIS-(TERT.-BUTYL)-4-HYDROXYCYCLOHEXA-2,5-DIENE-1-ONE]
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H46O4
InChI InChI=1S/C34H46O4/c1-29(2,3)23-17-33(37,18-24(27(23)35)30(4,5)6)21-13-15-22(16-14-21)34(38)19-25(31(7,8)9)28(36)26(20-34)32(10,11)12/h13-20,37-38H,1-12H3
InChIKey NYMYVEAUUOYHMK-UHFFFAOYSA-N
Literature Reference Author P.BOLDT,D.BRUHNKE,F.GERSON,M.SCHOLZ,P.G.JONES,F.BAER
Literature Reference Citation HELV.CHIM.ACTA,76,1739(1993)
Literature Reference DOI 10.1002/hlca.19930760430
Molecular Weight 518.737 g/mol
Solvent ACETONE-D6
Source File Reference UWRK1538