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diphenyl (R)-2-((3-(tert-butyl)-4-hydroxy-5-methylphenyl)(phenyl)methyl)malonate
SpectraBase Compound ID 1x1DYIQZGY7
InChI InChI=1S/C33H32O5/c1-22-20-24(21-27(30(22)34)33(2,3)4)28(23-14-8-5-9-15-23)29(31(35)37-25-16-10-6-11-17-25)32(36)38-26-18-12-7-13-19-26/h5-21,28-29,34H,1-4H3/t28-/m1/s1
InChIKey OSDYWCSKINIPDW-MUUNZHRXSA-N
Mol Weight 508.6 g/mol
Molecular Formula C33H32O5
Exact Mass 508.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RChYdE7Abk
Name diphenyl (R)-2-((3-(tert-butyl)-4-hydroxy-5-methylphenyl)(phenyl)methyl)malonate
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Formula C33H32O5
InChI InChI=1S/C33H32O5/c1-22-20-24(21-27(30(22)34)33(2,3)4)28(23-14-8-5-9-15-23)29(31(35)37-25-16-10-6-11-17-25)32(36)38-26-18-12-7-13-19-26/h5-21,28-29,34H,1-4H3/t28-/m1/s1
InChIKey OSDYWCSKINIPDW-MUUNZHRXSA-N
Literature Reference DOI 10.1002/anie.201303928
Molecular Weight 508.614 g/mol
SMILES Oc1c(cc(cc1C(C)(C)C)[C@@](c1ccccc1)(C(C(Oc1ccccc1)=O)C(Oc1ccccc1)=O)[H])C
SPLASH splash10-0udi-2090010000-77f76b5c1c18c97ee94d
Source of Spectrum ACI-52-SMS22-3ra
Wiley ID 1781600