SpectraBase Spectrum ID |
C3y59jF4Jnp |
Name |
quinolinium, 2-[(Z)-(3,5-dimethyl-2(3H)-benzothiazolylidene)methyl]-1-ethyl-, iodide |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
460.047014858 u |
Formula |
C21H21IN2S |
InChI |
InChI=1S/C21H21N2S.HI/c1-4-23-17(11-10-16-7-5-6-8-18(16)23)14-21-22(3)19-13-15(2)9-12-20(19)24-21;/h5-14H,4H2,1-3H3;1H/q+1;/p-1 |
InChIKey |
BUVVASVJAVELOD-UHFFFAOYSA-M |
Molecular Weight |
460.377 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_7731 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13308547 |