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3,4'-Isopropylidenediphenol, bis(trimethylacetate)

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3,4'-Isopropylidenediphenol, bis(trimethylacetate)
SpectraBase Compound ID 7k3mkjSSIWc
InChI InChI=1S/C25H32O4/c1-23(2,3)21(26)28-19-14-12-17(13-15-19)25(7,8)18-10-9-11-20(16-18)29-22(27)24(4,5)6/h9-16H,1-8H3
InChIKey YKSDCTUTFADCDC-UHFFFAOYSA-N
Mol Weight 396.5 g/mol
Molecular Formula C25H32O4
Exact Mass 396.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3lSBZSz7UCH
Name 3,4'-Isopropylidenediphenol, bis(trimethylacetate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.230059506 u
Formula C25H32O4
InChI InChI=1S/C25H32O4/c1-23(2,3)21(26)28-19-14-12-17(13-15-19)25(7,8)18-10-9-11-20(16-18)29-22(27)24(4,5)6/h9-16H,1-8H3
InChIKey YKSDCTUTFADCDC-UHFFFAOYSA-N
Molecular Weight 396.527 g/mol
SMILES C1(OC(C(C)(C)C)=O)=CC(=CC=C1)C(C)(C)C1=CC=C(C=C1)OC(C(C)(C)C)=O