SpectraBase Spectrum ID |
2c9TAwwqxou |
Name |
1-(4-methoxybenzyl)-4-(6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium 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 |
444.175060443 u |
Formula |
C23H29ClN4OS |
InChI |
InChI=1S/C23H28N4OS.ClH/c1-16-3-8-20-19(13-16)21-22(24-15-25-23(21)29-20)27-11-9-26(10-12-27)14-17-4-6-18(28-2)7-5-17;/h4-7,15-16H,3,8-14H2,1-2H3;1H |
InChIKey |
HUSZUHNNOMQQFB-UHFFFAOYSA-N |
Molecular Weight |
445.025 g/mol |
NMR Offset |
17.9889 |
NMR Spectrometer Frequency |
500.132 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_5037 |
Solvent |
CDCl3 |
Source |
Vendor ID: NMR/12318213 |