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2-Hydroxy-2-phenyl-2-[(2-hydroxyethyl)phenyl]acetic acid, 3-methyl-
SpectraBase Compound ID 1WhZgZ4o7qp
InChI InChI=1S/C32H38O4/c1-23-14-19-28(31(2,3)25-10-6-4-7-11-25)29(22-23)36-30(34)32(35,26-12-8-5-9-13-26)27-17-15-24(16-18-27)20-21-33/h4-13,15-18,23,28-29,33,35H,14,19-22H2,1-3H3
InChIKey OAPUOMABYHVIPI-UHFFFAOYSA-N
Mol Weight 486.7 g/mol
Molecular Formula C32H38O4
Exact Mass 486.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DTFTYmTFEdo
Name 2-Hydroxy-2-phenyl-2-[(2-hydroxyethyl)phenyl]acetic acid, 3-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 486.277009700 u
Formula C32H38O4
InChI InChI=1S/C32H38O4/c1-23-14-19-28(31(2,3)25-10-6-4-7-11-25)29(22-23)36-30(34)32(35,26-12-8-5-9-13-26)27-17-15-24(16-18-27)20-21-33/h4-13,15-18,23,28-29,33,35H,14,19-22H2,1-3H3
InChIKey OAPUOMABYHVIPI-UHFFFAOYSA-N
Molecular Weight 486.652 g/mol
SMILES C1=CC(=CC=C1CCO)C(C(OC1CC(CCC1C(C)(C)C1=CC=CC=C1)C)=O)(O)C1=CC=CC=C1