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(1SR,7RS,10SR)-7-(4-METHOXYPHENYL)-10-(4-TRIFLUOROMETHYLPHENYL)-OCTAHYDROPYRIDO-[1,2-D]-[1,4]-DIAZEPIN-2-ONE
SpectraBase Compound ID EacwgAGWQ90
InChI InChI=1S/C23H25F3N2O2/c1-30-18-8-4-16(5-9-18)20-11-10-19(21-14-22(29)27-12-13-28(20)21)15-2-6-17(7-3-15)23(24,25)26/h2-9,19-21H,10-14H2,1H3,(H,27,29)/t19-,20+,21-/m0/s1
InChIKey HFTFJBFDWXOVMP-HBMCJLEFSA-N
Mol Weight 418.46 g/mol
Molecular Formula C23H25F3N2O2
Exact Mass 418.186813 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ltYIl2mKL
Name (1SR,7RS,10SR)-7-(4-METHOXYPHENYL)-10-(4-TRIFLUOROMETHYLPHENYL)-OCTAHYDROPYRIDO-[1,2-D]-[1,4]-DIAZEPIN-2-ONE
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H25F3N2O2
InChI InChI=1S/C23H25F3N2O2/c1-30-18-8-4-16(5-9-18)20-11-10-19(21-14-22(29)27-12-13-28(20)21)15-2-6-17(7-3-15)23(24,25)26/h2-9,19-21H,10-14H2,1H3,(H,27,29)/t19-,20+,21-/m0/s1
InChIKey HFTFJBFDWXOVMP-HBMCJLEFSA-N
Literature Reference Author A.GHEORGHE,B.QUICLET-SIRE,X.VILA,S.Z.ZARD
Literature Reference Citation ORG.LETTERS,7,1653(2005)
Literature Reference DOI 10.1021/ol0503642
Molecular Weight 418.459 g/mol
Sample ID 62184
Solvent CDCl3