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isoquinolinium, 6,7-diethoxy-1,2,3,4-tetrahydro-1-(4-methoxy-3-methylphenyl)-, chloride
SpectraBase Compound ID 1kLP5xMCXK1
InChI InChI=1S/C21H27NO3.ClH/c1-5-24-19-12-15-9-10-22-21(17(15)13-20(19)25-6-2)16-7-8-18(23-4)14(3)11-16;/h7-8,11-13,21-22H,5-6,9-10H2,1-4H3;1H
InChIKey ZITQLELUAJBIPO-UHFFFAOYSA-N
Mol Weight 377.91 g/mol
Molecular Formula C21H28ClNO3
Exact Mass 377.175771 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ijix21AnJFr
Name isoquinolinium, 6,7-diethoxy-1,2,3,4-tetrahydro-1-(4-methoxy-3-methylphenyl)-, chloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 377.175771463 u
Formula C21H28ClNO3
InChI InChI=1S/C21H27NO3.ClH/c1-5-24-19-12-15-9-10-22-21(17(15)13-20(19)25-6-2)16-7-8-18(23-4)14(3)11-16;/h7-8,11-13,21-22H,5-6,9-10H2,1-4H3;1H
InChIKey ZITQLELUAJBIPO-UHFFFAOYSA-N
Molecular Weight 377.912 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14702
Solvent DMSO-d6
Source Vendor ID: NMR/10300754; Lab Info: GRI; Lab Number: GRI-0000007