| SpectraBase Spectrum ID |
rFM7yTNkGT |
| Name |
3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-, 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 |
379.141972775 u |
| Formula |
C22H21NO5 |
| InChI |
InChI=1S/C22H21NO5/c1-3-27-22(26)18-12(2)23-15-8-6-9-16(24)20(15)19(18)14-11-28-17-10-5-4-7-13(17)21(14)25/h4-5,7,10-11,19,23H,3,6,8-9H2,1-2H3 |
| InChIKey |
ZROOABQEMVDFHX-UHFFFAOYSA-N |
| Molecular Weight |
379.412 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8220 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9254452; Lab Info: SAS; Lab Number: SAS-TST2102 |
| Temperature |
29.85 °C |
