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2-Benzyl-3-oxo-6-exo-[4-(4-methylphenoxy)-phenoxy]-2-azabicyclo-[2.2.1]-heptane
SpectraBase Compound ID D8EaE9CXkcJ
InChI InChI=1S/C26H25NO3/c1-18-7-9-21(10-8-18)29-22-11-13-23(14-12-22)30-25-16-20-15-24(25)27(26(20)28)17-19-5-3-2-4-6-19/h2-14,20,24-25H,15-17H2,1H3/t20-,24+,25+/m0/s1
InChIKey NVALEPJVCBEUPN-BUUDZMLXSA-N
Mol Weight 399.49 g/mol
Molecular Formula C26H25NO3
Exact Mass 399.183444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ke2P1N1JqFA
Name 2-BENZYL-3-OXO-6-EXO-[4-(4-METHYLPHENOXY)-PHENOXY]-2-AZABICYCLO-[2.2.1]-HEPTANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H25NO3
InChI InChI=1S/C26H25NO3/c1-18-7-9-21(10-8-18)29-22-11-13-23(14-12-22)30-25-16-20-15-24(25)27(26(20)28)17-19-5-3-2-4-6-19/h2-14,20,24-25H,15-17H2,1H3/t20-,24+,25+/m0/s1
InChIKey NVALEPJVCBEUPN-BUUDZMLXSA-N
Literature Reference Author P.H.MAZZOCCHI,H.L.AMMON,L.LIU,E.COLICELLI,P.RAVI,E.BURROWS
Literature Reference Citation J.ORG.CHEM.,46,4530(1981)
Literature Reference DOI 10.1021/jo00335a042
Molecular Weight 399.489 g/mol
Solvent CDCl3
Source File Reference UNIW18910