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isoquinolinium, 1-[4-(1,1-dimethylethyl)phenyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-, chloride
SpectraBase Compound ID Dv1wlJBGF6
InChI InChI=1S/C21H27NO2.ClH/c1-21(2,3)16-8-6-14(7-9-16)20-17-13-19(24-5)18(23-4)12-15(17)10-11-22-20;/h6-9,12-13,20,22H,10-11H2,1-5H3;1H
InChIKey XGIJKUZXNCPNEZ-UHFFFAOYSA-N
Mol Weight 361.91 g/mol
Molecular Formula C21H28ClNO2
Exact Mass 361.180857 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G0dNLH2nNVf
Name isoquinolinium, 1-[4-(1,1-dimethylethyl)phenyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-, 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 361.180856844 u
Formula C21H28ClNO2
InChI InChI=1S/C21H27NO2.ClH/c1-21(2,3)16-8-6-14(7-9-16)20-17-13-19(24-5)18(23-4)12-15(17)10-11-22-20;/h6-9,12-13,20,22H,10-11H2,1-5H3;1H
InChIKey XGIJKUZXNCPNEZ-UHFFFAOYSA-N
Molecular Weight 361.913 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10118
Solvent DMSO-d6
Source Vendor ID: NMR/10240660; Lab Info: GRI; Lab Number: GRI-0001036