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[2'',6''-bis(T-Butyl)-p-tolyl] 2-[6'-methoxynaphthalen-2'-yl)propanoate

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[2'',6''-bis(T-Butyl)-p-tolyl] 2-[6'-methoxynaphthalen-2'-yl)propanoate
SpectraBase Compound ID F4n13LY3AiQ
InChI InChI=1S/C29H36O3/c1-18-14-24(28(3,4)5)26(25(15-18)29(6,7)8)32-27(30)19(2)20-10-11-22-17-23(31-9)13-12-21(22)16-20/h10-17,19H,1-9H3
InChIKey NJRPLVOFHGEKQJ-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C29H36O3
Exact Mass 432.266445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EVdnWnXfLCi
Name [2'',6''-bis(T-Butyl)-p-tolyl] 2-[6'-methoxynaphthalen-2'-yl)propanoate
Comments Computed using HOSE algorithm
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Exact Mass 432.266445016 u
Formula C29H36O3
InChI InChI=1S/C29H36O3/c1-18-14-24(28(3,4)5)26(25(15-18)29(6,7)8)32-27(30)19(2)20-10-11-22-17-23(31-9)13-12-21(22)16-20/h10-17,19H,1-9H3
InChIKey NJRPLVOFHGEKQJ-UHFFFAOYSA-N
Molecular Weight 432.604 g/mol
SMILES C1(OC(C(C=2C=C3C=CC(=CC3=CC2)OC)C)=O)=C(C(C)(C)C)C=C(C=C1C(C)(C)C)C