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Bisphenol tmc, bis(trimethylacetate)

View entire compound with spectra: 1 NMR

Bisphenol tmc, bis(trimethylacetate)
SpectraBase Compound ID CL2dTV9y6hb
InChI InChI=1S/C31H42O4/c1-21-18-30(8,9)20-31(19-21,22-10-14-24(15-11-22)34-26(32)28(2,3)4)23-12-16-25(17-13-23)35-27(33)29(5,6)7/h10-17,21H,18-20H2,1-9H3
InChIKey PZAHVBMUBRWHML-UHFFFAOYSA-N
Mol Weight 478.7 g/mol
Molecular Formula C31H42O4
Exact Mass 478.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7CGlvVHFkwm
Name Bisphenol tmc, bis(trimethylacetate)
Comments Computed using HOSE algorithm
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Exact Mass 478.308309828 u
Formula C31H42O4
InChI InChI=1S/C31H42O4/c1-21-18-30(8,9)20-31(19-21,22-10-14-24(15-11-22)34-26(32)28(2,3)4)23-12-16-25(17-13-23)35-27(33)29(5,6)7/h10-17,21H,18-20H2,1-9H3
InChIKey PZAHVBMUBRWHML-UHFFFAOYSA-N
Molecular Weight 478.673 g/mol
SMILES C1=CC(OC(C(C)(C)C)=O)=CC=C1C1(CC(C)(C)CC(C1)C)C1=CC=C(C=C1)OC(C(C)(C)C)=O