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2,2-bis(4-Hydroxy-3-methylphenyl)-4-methylpentane, trimethylacetate

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2,2-bis(4-Hydroxy-3-methylphenyl)-4-methylpentane, trimethylacetate
SpectraBase Compound ID Lbor8h0db4w
InChI InChI=1S/C25H34O3/c1-16(2)15-25(8,19-9-11-21(26)17(3)13-19)20-10-12-22(18(4)14-20)28-23(27)24(5,6)7/h9-14,16,26H,15H2,1-8H3
InChIKey GESVMSKJTXJGHT-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C25H34O3
Exact Mass 382.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ynaFf1rOlK
Name 2,2-bis(4-Hydroxy-3-methylphenyl)-4-methylpentane, trimethylacetate
Comments Computed using HOSE algorithm
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Exact Mass 382.250794952 u
Formula C25H34O3
InChI InChI=1S/C25H34O3/c1-16(2)15-25(8,19-9-11-21(26)17(3)13-19)20-10-12-22(18(4)14-20)28-23(27)24(5,6)7/h9-14,16,26H,15H2,1-8H3
InChIKey GESVMSKJTXJGHT-UHFFFAOYSA-N
Molecular Weight 382.544 g/mol
SMILES C1(O)=C(C=C(C=C1)C(CC(C)C)(C)C1=CC(=C(C=C1)OC(C(C)(C)C)=O)C)C