| SpectraBase Spectrum ID |
Dubfoa1Qzax |
| Name |
3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-, 2-methoxyethyl 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 |
409.150092677 u |
| Formula |
C21H22F3NO4 |
| InChI |
InChI=1S/C21H22F3NO4/c1-12-17(20(27)29-11-10-28-2)18(19-15(25-12)4-3-5-16(19)26)13-6-8-14(9-7-13)21(22,23)24/h6-9,18,25H,3-5,10-11H2,1-2H3 |
| InChIKey |
YUDUYEWSDBMQAQ-UHFFFAOYSA-N |
| Molecular Weight |
409.405 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_9342 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10240473; Lab Info: SAS; Lab Number: SAS-tst3661 |
| Temperature |
23.85 °C |
![3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-, 2-methoxyethyl ester](/api/spectrum/Dubfoa1Qzax/structure.png?h=300&w=458 "3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-, 2-methoxyethyl ester")
