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isoquinolinium, 6,7-diethoxy-1,2,3,4-tetrahydro-1-[4-(1-methylethoxy)phenyl]-, chloride
SpectraBase Compound ID CxD9hlarkVI
InChI InChI=1S/C22H29NO3.ClH/c1-5-24-20-13-17-11-12-23-22(19(17)14-21(20)25-6-2)16-7-9-18(10-8-16)26-15(3)4;/h7-10,13-15,22-23H,5-6,11-12H2,1-4H3;1H
InChIKey CKFFNPNDYZVKJN-UHFFFAOYSA-N
Mol Weight 391.94 g/mol
Molecular Formula C22H30ClNO3
Exact Mass 391.191422 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DEcpZR1xHw
Name isoquinolinium, 6,7-diethoxy-1,2,3,4-tetrahydro-1-[4-(1-methylethoxy)phenyl]-, 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 391.191421527 u
Formula C22H30ClNO3
InChI InChI=1S/C22H29NO3.ClH/c1-5-24-20-13-17-11-12-23-22(19(17)14-21(20)25-6-2)16-7-9-18(10-8-16)26-15(3)4;/h7-10,13-15,22-23H,5-6,11-12H2,1-4H3;1H
InChIKey CKFFNPNDYZVKJN-UHFFFAOYSA-N
Molecular Weight 391.939 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16112
Solvent DMSO-d6
Source Vendor ID: NMR/11250238; Lab Info: GRIN; Lab Number: GRIN-0104137