| SpectraBase Spectrum ID |
1cREn7lLszF |
| Name |
3-quinolinecarboxylic acid, 4-(2-chloro-5-nitrophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, 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 |
420.108814098 u |
| Formula |
C20H21ClN2O6 |
| InChI |
InChI=1S/C20H21ClN2O6/c1-11-17(20(25)29-9-8-28-2)18(19-15(22-11)4-3-5-16(19)24)13-10-12(23(26)27)6-7-14(13)21/h6-7,10,18,22H,3-5,8-9H2,1-2H3 |
| InChIKey |
VQKJUBNVBBGHMB-UHFFFAOYSA-N |
| Molecular Weight |
420.849 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11206 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10251688; Lab Info: SAS; Lab Number: SAS-tst3728 |
| Temperature |
29.85 °C |
