SpectraBase Spectrum ID |
ApygQ6xx0pM |
Name |
benzoic acid, 4-[[[(2-methyl-8-quinolinyl)thio]acetyl]amino]-, butylester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
408.150763812 u |
Formula |
C23H24N2O3S |
InChI |
InChI=1S/C23H24N2O3S/c1-3-4-14-28-23(27)18-10-12-19(13-11-18)25-21(26)15-29-20-7-5-6-17-9-8-16(2)24-22(17)20/h5-13H,3-4,14-15H2,1-2H3,(H,25,26) |
InChIKey |
OEFJQMKMDYYJPU-UHFFFAOYSA-N |
Molecular Weight |
408.516 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_13913 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10300203; Lab Info: LP; Lab Number: LP-2171048 |