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N,N-DIMETHYL-(6,10B,11,12-TETRAHYDRO-PYRROLO-[1',2':2,3]-PYRIDAZINO-[6,1-A]-ISOINDOL-6-ONE-12-YL)-IMINIUM-PERCHLORATE
SpectraBase Compound ID 6qLOOlK7xRB
InChI InChI=1S/C16H16N3O.ClHO4/c1-17(2)15-10-14-11-6-3-4-7-12(11)16(20)19(14)18-9-5-8-13(15)18;2-1(3,4)5/h3-9,14H,10H2,1-2H3;(H,2,3,4,5)/q+1;/p-1
InChIKey MLRXTBYIQHAWQL-UHFFFAOYSA-M
Mol Weight 365.77 g/mol
Molecular Formula C16H16ClN3O5
Exact Mass 365.077848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6xDlDe7sRoZ
Name N,N-DIMETHYL-(6,10B,11,12-TETRAHYDRO-PYRROLO-[1',2':2,3]-PYRIDAZINO-[6,1-A]-ISOINDOL-6-ONE-12-YL)-IMINIUM-PERCHLORATE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16ClN3O5
InChI InChI=1S/C16H16N3O.ClHO4/c1-17(2)15-10-14-11-6-3-4-7-12(11)16(20)19(14)18-9-5-8-13(15)18;2-1(3,4)5/h3-9,14H,10H2,1-2H3;(H,2,3,4,5)/q+1;/p-1
InChIKey MLRXTBYIQHAWQL-UHFFFAOYSA-M
Literature Reference Author S.MARCHALIN,B.DECROIX
Literature Reference Citation HETEROCYCLES,43,2595(1996)
Literature Reference DOI 10.3987/COM-96-7559
Molecular Weight 365.773 g/mol
Solvent DMSO-D6
Source File Reference UWCP6308