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(1-ALPHA,4-ALPHA,9-BETA,9A-ALPHA,10-BETA,10A-ALPHA)-8-TERT.-BUTYL-1,2,3,4-TETRAPHENYL-1,4,9,9A,10,10A-HEXAHYDRO-9,10-EPOXY-1,4-METHANOANTHRACENE-5,6,12-TRIONE;
SpectraBase Compound ID AjNxGO35u8g
InChI InChI=1S/C43H34O4/c1-41(2,3)29-24-30(44)37(45)32-31(29)38-35-36(39(32)47-38)43(28-22-14-7-15-23-28)34(26-18-10-5-11-19-26)33(25-16-8-4-9-17-25)42(35,40(43)46)27-20-12-6-13-21-27/h4-24,35-36,38-39H,1-3H3/t35-,36+,38+,39-,42+,43-/m1/s1
InChIKey SSYGPWBPIZQHEK-LQQJGSPNSA-N
Mol Weight 614.7 g/mol
Molecular Formula C43H34O4
Exact Mass 614.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID SHUYqEzr8O
Name (1-ALPHA,4-ALPHA,9-BETA,9A-ALPHA,10-BETA,10A-ALPHA)-8-TERT.-BUTYL-1,2,3,4-TETRAPHENYL-1,4,9,9A,10,10A-HEXAHYDRO-9,10-EPOXY-1,4-METHANOANTHRACENE-5,6,12-TRIONE;
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H34O4
InChI InChI=1S/C43H34O4/c1-41(2,3)29-24-30(44)37(45)32-31(29)38-35-36(39(32)47-38)43(28-22-14-7-15-23-28)34(26-18-10-5-11-19-26)33(25-16-8-4-9-17-25)42(35,40(43)46)27-20-12-6-13-21-27/h4-24,35-36,38-39H,1-3H3/t35-,36+,38+,39-,42+,43-/m1/s1
InChIKey SSYGPWBPIZQHEK-LQQJGSPNSA-N
Literature Reference Author C.G.SIMS,D.WEGE
Literature Reference Citation AUSTR.J.CHEM.,45,1983(1992)
Literature Reference DOI 10.1071/ch9921983
Molecular Weight 614.741 g/mol
Solvent Unknown
Source File Reference UWTS1921