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Bisphenol tmc, bis(trifluoroacetate)

View entire compound with spectra: 1 NMR

Bisphenol tmc, bis(trifluoroacetate)
SpectraBase Compound ID Ff7GLat8y5d
InChI InChI=1S/C25H24F6O4/c1-15-12-22(2,3)14-23(13-15,16-4-8-18(9-5-16)34-20(32)24(26,27)28)17-6-10-19(11-7-17)35-21(33)25(29,30)31/h4-11,15H,12-14H2,1-3H3
InChIKey UMVJFHFJNIXZNQ-UHFFFAOYSA-N
Mol Weight 502.45 g/mol
Molecular Formula C25H24F6O4
Exact Mass 502.157878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DqOloicKp47
Name Bisphenol tmc, bis(trifluoroacetate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 502.157878227 u
Formula C25H24F6O4
InChI InChI=1S/C25H24F6O4/c1-15-12-22(2,3)14-23(13-15,16-4-8-18(9-5-16)34-20(32)24(26,27)28)17-6-10-19(11-7-17)35-21(33)25(29,30)31/h4-11,15H,12-14H2,1-3H3
InChIKey UMVJFHFJNIXZNQ-UHFFFAOYSA-N
Molecular Weight 502.453 g/mol
SMILES C1=CC(OC(C(F)(F)F)=O)=CC=C1C1(CC(C)(C)CC(C1)C)C1=CC=C(C=C1)OC(C(F)(F)F)=O