SpectraBase Spectrum ID |
8bq9wrqFhW3 |
Name |
[1,3]dioxolo[4,5-g]quinolin-6-ol, 7-[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio]-8-methyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
406.109961627 u |
Formula |
C21H18N4O3S |
InChI |
InChI=1S/C21H18N4O3S/c1-3-25-19(13-7-5-4-6-8-13)23-24-21(25)29-18-12(2)14-9-16-17(28-11-27-16)10-15(14)22-20(18)26/h4-10H,3,11H2,1-2H3,(H,22,26) |
InChIKey |
KLEVHXKQWMPNBP-UHFFFAOYSA-N |
Molecular Weight |
406.460 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_11731 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10271451; Lab Info: PREZ; Lab Number: PREZ-X000077 |