SpectraBase Spectrum ID |
5cJUmwUjn8W |
Name |
isoquinolinium, 1-(2,4-dimethylphenyl)-6,7-diethoxy-1,2,3,4-tetrahydro-, 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/c1-5-23-19-12-16-9-10-22-21(18(16)13-20(19)24-6-2)17-8-7-14(3)11-15(17)4;/h7-8,11-13,21-22H,5-6,9-10H2,1-4H3;1H |
InChIKey |
BXIMFRPUDFUIJM-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_14740 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10300753; Lab Info: GRI; Lab Number: GRI-0000006 |