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1-BENZOYL-6-METHOXY-7-PENTANYLOXY-3,4-DIHYDROISOQUINOLINE
SpectraBase Compound ID Hd8WcmxfmfV
InChI InChI=1S/C22H25NO3/c1-3-4-8-13-26-20-15-18-17(14-19(20)25-2)11-12-23-21(18)22(24)16-9-6-5-7-10-16/h5-7,9-10,14-15H,3-4,8,11-13H2,1-2H3
InChIKey NSHPATPCFZGSSG-UHFFFAOYSA-N
Mol Weight 351.45 g/mol
Molecular Formula C22H25NO3
Exact Mass 351.183444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1DYGOJCXcnP
Name 1-BENZOYL-6-METHOXY-7-PENTANYLOXY-3,4-DIHYDROISOQUINOLINE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25NO3
InChI InChI=1S/C22H25NO3/c1-3-4-8-13-26-20-15-18-17(14-19(20)25-2)11-12-23-21(18)22(24)16-9-6-5-7-10-16/h5-7,9-10,14-15H,3-4,8,11-13H2,1-2H3
InChIKey NSHPATPCFZGSSG-UHFFFAOYSA-N
Literature Reference Author A.BERMEJO,I.ANDREU,F.SUVIRE,S.LEONCE,D.H.CAIGNARD,P.RENARD,A .PIERRE,R.D.ENRIZ,D.
Literature Reference Citation J.MED.CHEM.,45,5058(2002)
Literature Reference DOI 10.1021/jm020831a
Molecular Weight 351.445 g/mol
Sample ID 65178
Solvent CDCl3