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9a-(Dimethylamino)-1,2-diphenyl-3a,4,5,6,7,8,9,9a-octahydrocyclopenta[a]azulen-3-one
SpectraBase Compound ID EP3ksmr3L7y
InChI InChI=1S/C27H29NO/c1-28(2)27-18-21-16-10-5-11-17-22(21)25(27)26(29)23(19-12-6-3-7-13-19)24(27)20-14-8-4-9-15-20/h3-4,6-9,12-15,25H,5,10-11,16-18H2,1-2H3/t25-,27-/m1/s1
InChIKey FKFFHDFNZAHQCA-XNMGPUDCSA-N
Mol Weight 383.54 g/mol
Molecular Formula C27H29NO
Exact Mass 383.224915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FLyMfPeM5cL
Name 9A-DIMETHYLAMINO-1,2-DIPHENYL-3A,4,5,6,7,8,9,9A-OCTAHYDROCYCLOPENTA-[A]-AZULEN-3-ONE
Compound Number 15CA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H29NO
InChI InChI=1S/C27H29NO/c1-28(2)27-18-21-16-10-5-11-17-22(21)25(27)26(29)23(19-12-6-3-7-13-19)24(27)20-14-8-4-9-15-20/h3-4,6-9,12-15,25H,5,10-11,16-18H2,1-2H3/t25-,27-/m1/s1
InChIKey FKFFHDFNZAHQCA-XNMGPUDCSA-N
Literature Reference Author Y.T.WU,D.VIDOVIC,J.MAGULL,A.D.MEIJERE
Literature Reference Citation EUR.J.ORG.CHEM.,1625(2005)
Literature Reference DOI 10.1002/ejoc.200400858
Molecular Weight 383.533 g/mol
Sample ID 31056
Solvent CDCl3