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(3AR*,4R*,10AR*)-4-(4'-METHOXYPHENYL)-1-PHENYL-3,3A,4,5,6,8-HEXAHYDROCYCLOPENTA-[D]-NAPHTHALENE-3,8-DIONE
SpectraBase Compound ID 4kSJ5bcjXJA
InChI InChI=1S/C26H22O3/c1-29-21-10-7-17(8-11-21)22-12-9-19-15-20(27)13-14-26(19)23(16-24(28)25(22)26)18-5-3-2-4-6-18/h2-8,10-11,13-16,22,25H,9,12H2,1H3/t22-,25-,26+/m1/s1
InChIKey UDURGCFHMZCQSJ-RCXJIHSJSA-N
Mol Weight 382.46 g/mol
Molecular Formula C26H22O3
Exact Mass 382.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EI2hmrDTKDC
Name (3AR*,4R*,10AR*)-4-(4'-METHOXYPHENYL)-1-PHENYL-3,3A,4,5,6,8-HEXAHYDROCYCLOPENTA-[D]-NAPHTHALENE-3,8-DIONE
Compound Number 21A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H22O3
InChI InChI=1S/C26H22O3/c1-29-21-10-7-17(8-11-21)22-12-9-19-15-20(27)13-14-26(19)23(16-24(28)25(22)26)18-5-3-2-4-6-18/h2-8,10-11,13-16,22,25H,9,12H2,1H3/t22-,25-,26+/m1/s1
InChIKey UDURGCFHMZCQSJ-RCXJIHSJSA-N
Literature Reference Author F.T.BOYLE,O.HARES,Z.S.MATUSIAK,W.LI,D.A.WHITING
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2707(1997)
Literature Reference DOI 10.1039/a702992f
Molecular Weight 382.459 g/mol
Solvent Unknown
Source File Reference UWKP2257