SpectraBase Spectrum ID |
8S458vkkcin |
Name |
4-quinolinecarboxylic acid, 2-[4-(methylthio)phenyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.066699835 u |
Formula |
C17H13NO2S |
InChI |
InChI=1S/C17H13NO2S/c1-21-12-8-6-11(7-9-12)16-10-14(17(19)20)13-4-2-3-5-15(13)18-16/h2-10H,1H3,(H,19,20) |
InChIKey |
BBIIPPSFAVUZGD-UHFFFAOYSA-N |
Molecular Weight |
295.356 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5065 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9291128; Lab Info: LP; Lab Number: LP-3300102 |