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isoquinolinium, 6,7-diethoxy-1,2,3,4-tetrahydro-1-(2,4,5-trimethoxyphenyl)-, chloride
SpectraBase Compound ID DQ46ES80ljJ
InChI InChI=1S/C22H29NO5.ClH/c1-6-27-20-10-14-8-9-23-22(15(14)11-21(20)28-7-2)16-12-18(25-4)19(26-5)13-17(16)24-3;/h10-13,22-23H,6-9H2,1-5H3;1H
InChIKey VAAMUYSUQLHJGC-UHFFFAOYSA-N
Mol Weight 423.94 g/mol
Molecular Formula C22H30ClNO5
Exact Mass 423.181251 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KtjBsGvs7QR
Name isoquinolinium, 6,7-diethoxy-1,2,3,4-tetrahydro-1-(2,4,5-trimethoxyphenyl)-, 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 423.181250765 u
Formula C22H30ClNO5
InChI InChI=1S/C22H29NO5.ClH/c1-6-27-20-10-14-8-9-23-22(15(14)11-21(20)28-7-2)16-12-18(25-4)19(26-5)13-17(16)24-3;/h10-13,22-23H,6-9H2,1-5H3;1H
InChIKey VAAMUYSUQLHJGC-UHFFFAOYSA-N
Molecular Weight 423.937 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17152
Solvent DMSO-d6
Source Vendor ID: NMR/10300764; Lab Info: GRI; Lab Number: GRI-0000017