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(1-ALPHA,5-ALPHA,5A-BETA,8A-BETA)-7-METHYL-6-OXO-8,8A-DIPHENYL-1,2,5,5A,6,8A-HEXAHYDRO-1,5-ETHENOCYCLOPENT-[C]-AZEPINE-2,5A-DICARBOXYLIC-ACID-2-
SpectraBase Compound ID IFLtcgxNypy
InChI InChI=1S/C29H27NO5/c1-4-35-27(33)30-18-17-22-15-16-23(30)28(21-13-9-6-10-14-21)24(20-11-7-5-8-12-20)19(2)25(31)29(22,28)26(32)34-3/h5-18,22-23H,4H2,1-3H3/t22-,23+,28+,29-/m0/s1
InChIKey FZJROHCVQYXBLV-LAVAFMAYSA-N
Mol Weight 469.54 g/mol
Molecular Formula C29H27NO5
Exact Mass 469.188923 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B8al1gLangI
Name (1-ALPHA,5-ALPHA,5A-BETA,8A-BETA)-7-METHYL-6-OXO-8,8A-DIPHENYL-1,2,5,5A,6,8A-HEXAHYDRO-1,5-ETHENOCYCLOPENT-[C]-AZEPINE-2,5A-DICARBOXYLIC-ACID-2-
Compound Number 11AI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H27NO5
InChI InChI=1S/C29H27NO5/c1-4-35-27(33)30-18-17-22-15-16-23(30)28(21-13-9-6-10-14-21)24(20-11-7-5-8-12-20)19(2)25(31)29(22,28)26(32)34-3/h5-18,22-23H,4H2,1-3H3/t22-,23+,28+,29-/m0/s1
InChIKey FZJROHCVQYXBLV-LAVAFMAYSA-N
Literature Reference Author T.JIKYO,M.ETO,K.HARANO
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3463(1998)
Literature Reference DOI 10.1039/a804671i
Molecular Weight 469.537 g/mol
Solvent CDCl3
Source File Reference UWSI7358