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diphenyl (R)-2-(1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2,2-dimethylpropyl)malonate
SpectraBase Compound ID 8jHtQfmohGE
InChI InChI=1S/C34H42O5/c1-32(2,3)25-20-22(21-26(29(25)35)33(4,5)6)28(34(7,8)9)27(30(36)38-23-16-12-10-13-17-23)31(37)39-24-18-14-11-15-19-24/h10-21,27-28,35H,1-9H3/t28-/m1/s1
InChIKey YAGFXERDXWVJJK-MUUNZHRXSA-N
Mol Weight 530.7 g/mol
Molecular Formula C34H42O5
Exact Mass 530.303224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L7QIdOreyVS
Name Diphenyl (R)-2-(1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2,2-dimethylpropyl)malonate
Comments Computed using HOSE algorithm
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Exact Mass 530.303224447 u
Formula C34H42O5
InChI InChI=1S/C34H42O5/c1-32(2,3)25-20-22(21-26(29(25)35)33(4,5)6)28(34(7,8)9)27(30(36)38-23-16-12-10-13-17-23)31(37)39-24-18-14-11-15-19-24/h10-21,27-28,35H,1-9H3/t28-/m1/s1
InChIKey YAGFXERDXWVJJK-MUUNZHRXSA-N
Molecular Weight 530.705 g/mol
SMILES C=1(C(=C(C(C)(C)C)C=C(C1)[C@](C(C(OC1=CC=CC=C1)=O)C(OC1=CC=CC=C1)=O)(C(C)(C)C)[H])O)C(C)(C)C