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diphenyl (R)-2-((4-hydroxy-3,5-diisopropylphenyl)(phenyl)methyl)malonate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

diphenyl (R)-2-((4-hydroxy-3,5-diisopropylphenyl)(phenyl)methyl)malonate
SpectraBase Compound ID 6QLxerbZewN
InChI InChI=1S/C34H34O5/c1-22(2)28-20-25(21-29(23(3)4)32(28)35)30(24-14-8-5-9-15-24)31(33(36)38-26-16-10-6-11-17-26)34(37)39-27-18-12-7-13-19-27/h5-23,30-31,35H,1-4H3/t30-/m1/s1
InChIKey VMNFLEBIRZPMPX-SSEXGKCCSA-N
Mol Weight 522.6 g/mol
Molecular Formula C34H34O5
Exact Mass 522.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5iDduM22cpt
Name Diphenyl (R)-2-((4-hydroxy-3,5-diisopropylphenyl)(phenyl)methyl)malonate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 522.240624190 u
Formula C34H34O5
InChI InChI=1S/C34H34O5/c1-22(2)28-20-25(21-29(23(3)4)32(28)35)30(24-14-8-5-9-15-24)31(33(36)38-26-16-10-6-11-17-26)34(37)39-27-18-12-7-13-19-27/h5-23,30-31,35H,1-4H3/t30-/m1/s1
InChIKey VMNFLEBIRZPMPX-SSEXGKCCSA-N
Molecular Weight 522.641 g/mol
SMILES C=1(C(=C(C=C(C1)[C@@](C1=CC=CC=C1)(C(C(OC1=CC=CC=C1)=O)C(OC=1C=CC=CC1)=O)[H])C(C)C)O)C(C)C