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Bisphenol af, bis(trimethylacetate)

View entire compound with spectra: 1 NMR

Bisphenol af, bis(trimethylacetate)
SpectraBase Compound ID 1uup4kwOGI8
InChI InChI=1S/C25H26F6O4/c1-21(2,3)19(32)34-17-11-7-15(8-12-17)23(24(26,27)28,25(29,30)31)16-9-13-18(14-10-16)35-20(33)22(4,5)6/h7-14H,1-6H3
InChIKey SHBPWADCTMTVQI-UHFFFAOYSA-N
Mol Weight 504.47 g/mol
Molecular Formula C25H26F6O4
Exact Mass 504.173528 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 72Fml5NS0RK
Name Bisphenol af, bis(trimethylacetate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 504.173528291 u
Formula C25H26F6O4
InChI InChI=1S/C25H26F6O4/c1-21(2,3)19(32)34-17-11-7-15(8-12-17)23(24(26,27)28,25(29,30)31)16-9-13-18(14-10-16)35-20(33)22(4,5)6/h7-14H,1-6H3
InChIKey SHBPWADCTMTVQI-UHFFFAOYSA-N
Molecular Weight 504.469 g/mol
SMILES C(C(F)(F)F)(C(F)(F)F)(C1=CC=C(C=C1)OC(C(C)(C)C)=O)C1=CC=C(C=C1)OC(C(C)(C)C)=O