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Dimethyl (6-hydroxy-.alpha.,alpha.,alpha.-triphenyl-m-tolyl)succinate
SpectraBase Compound ID 8y4GGkmhs9L
InChI InChI=1S/C31H28O5/c1-35-29(33)21-27(30(34)36-2)26-20-25(18-19-28(26)32)31(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-20,27,32H,21H2,1-2H3
InChIKey LTNNFDXSQRHWKP-UHFFFAOYSA-N
Mol Weight 480.56 g/mol
Molecular Formula C31H28O5
Exact Mass 480.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Wi8fxNNp44
Name Dimethyl (6-hydroxy-.alpha.,alpha.,alpha.-triphenyl-m-tolyl)succinate
Comments Computed using HOSE algorithm
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Exact Mass 480.193673997 u
Formula C31H28O5
InChI InChI=1S/C31H28O5/c1-35-29(33)21-27(30(34)36-2)26-20-25(18-19-28(26)32)31(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-20,27,32H,21H2,1-2H3
InChIKey LTNNFDXSQRHWKP-UHFFFAOYSA-N
Molecular Weight 480.560 g/mol
SMILES C=1(C(C(=O)OC)CC(=O)OC)C=C(C(C2=CC=CC=C2)(C=2C=CC=CC2)C=2C=CC=CC2)C=CC1O