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2,2'-Methylenebis(6-tert-butyl-4 methylphenol), trifluoroacetate

View entire compound with spectra: 1 NMR

2,2'-Methylenebis(6-tert-butyl-4 methylphenol), trifluoroacetate
SpectraBase Compound ID Ewddre5d6r0
InChI InChI=1S/C25H31F3O3/c1-14-9-16(20(29)18(11-14)23(3,4)5)13-17-10-15(2)12-19(24(6,7)8)21(17)31-22(30)25(26,27)28/h9-12,29H,13H2,1-8H3
InChIKey QZYXMGVZBATZKO-UHFFFAOYSA-N
Mol Weight 436.52 g/mol
Molecular Formula C25H31F3O3
Exact Mass 436.222529 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KH4m9stTJ2p
Name 2,2'-Methylenebis(6-tert-butyl-4 methylphenol), trifluoroacetate
Comments Computed using HOSE algorithm
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Exact Mass 436.222529344 u
Formula C25H31F3O3
InChI InChI=1S/C25H31F3O3/c1-14-9-16(20(29)18(11-14)23(3,4)5)13-17-10-15(2)12-19(24(6,7)8)21(17)31-22(30)25(26,27)28/h9-12,29H,13H2,1-8H3
InChIKey QZYXMGVZBATZKO-UHFFFAOYSA-N
Molecular Weight 436.515 g/mol
SMILES C(C1=C(OC(C(F)(F)F)=O)C(C(C)(C)C)=CC(=C1)C)C1=C(O)C(C(C)(C)C)=CC(=C1)C