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2-BENZYLOXY-3-METHOXY-8-METHYLISOCHINO-[2,1-B]-[2,7]-NAPHTHYDRINIUMCHLORIDE
SpectraBase Compound ID 9OXy4qKlkzo
InChI InChI=1S/C25H21N2O2.ClH/c1-17-22-15-26-10-8-19(22)12-23-21-14-25(29-16-18-6-4-3-5-7-18)24(28-2)13-20(21)9-11-27(17)23;/h3-15H,16H2,1-2H3;1H/q+1;/p-1
InChIKey NPBOOQIXCLGBID-UHFFFAOYSA-M
Mol Weight 416.91 g/mol
Molecular Formula C25H21ClN2O2
Exact Mass 416.129156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID XDPUiPqK6e
Name 2-BENZYLOXY-3-METHOXY-8-METHYLISOCHINO-[2,1-B]-[2,7]-NAPHTHYDRINIUMCHLORIDE
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H21ClN2O2
InChI InChI=1S/C25H21N2O2.ClH/c1-17-22-15-26-10-8-19(22)12-23-21-14-25(29-16-18-6-4-3-5-7-18)24(28-2)13-20(21)9-11-27(17)23;/h3-15H,16H2,1-2H3;1H/q+1;/p-1
InChIKey NPBOOQIXCLGBID-UHFFFAOYSA-M
Literature Reference Author E.REIMANN,H.RENZ
Literature Reference Citation MH.CHEM.,125,1397(1994)
Literature Reference DOI 10.1007/BF00811089
Molecular Weight 416.907 g/mol
Solvent CDCl3
Source File Reference UWPR1409