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3,5-Di-tert-butyl-1,2-benzoquinone

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  1. Vaclav Horak1,
  2. Youco Mermersky1,
  3. Vijay Nair2,3,
  4. Ani Deepthi2,3

Published Online: 16 SEP 2013

DOI: 10.1002/047084289X.rd057.pub2

e-EROS Encyclopedia of Reagents for Organic Synthesis

e-EROS Encyclopedia of Reagents for Organic Synthesis

COMPOUND RECORD :


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Summary

Compound Information

FormulaC32H34O2
Molecular Weight450.6112
SynonymsNot available

Structure Descriptors

SMILES:CC(C)(C)C1=C[C@@]2(C3C=CC(C3[C@H]1C(=O)C2=O)=C(c1ccccc1)c1ccccc1)C(C)(C)C
InChI:1S/C32H34O2/c1-30(2,3)24-19-32(31(4,5)6)23-18-17-22(26(23)27(24)28(33)29(32)34)25(20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-19,23,26-27H,1-6H3/t23?,26?,27-,32-/m0/s1
InChIKey:SAQYQWZVFVEUEV-BHWQQCGTSA-N