| SpectraBase Spectrum ID |
9T35ezb8BU |
| Name |
3-quinolinecarboxylic acid, 4-(4-ethoxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, 2-(ethylthio)ethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
415.181729588 u |
| Formula |
C23H29NO4S |
| InChI |
InChI=1S/C23H29NO4S/c1-4-27-17-11-9-16(10-12-17)21-20(23(26)28-13-14-29-5-2)15(3)24-18-7-6-8-19(25)22(18)21/h9-12,21,24H,4-8,13-14H2,1-3H3 |
| InChIKey |
WYROKZYMYZSLNB-UHFFFAOYSA-N |
| Molecular Weight |
415.548 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_862 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8099558; Lab Info: SAS; Lab Number: SAS-0050386 |
