SpectraBase Spectrum ID |
LkTAcp3Shu7 |
Name |
3-quinolinecarboxylic acid, 4-[1,1'-biphenyl]-4-yl-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, 2-methoxyethyl ester |
Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
417.194008349 u |
Formula |
C26H27NO4 |
InChI |
InChI=1S/C26H27NO4/c1-17-23(26(29)31-16-15-30-2)24(25-21(27-17)9-6-10-22(25)28)20-13-11-19(12-14-20)18-7-4-3-5-8-18/h3-5,7-8,11-14,24,27H,6,9-10,15-16H2,1-2H3 |
InChIKey |
MTHUPHUKUZYUSE-UHFFFAOYSA-N |
Molecular Weight |
417.505 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_11175 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10251630; Lab Info: SAS; Lab Number: SAS-tst3665 |
Temperature |
29.85 °C |