SpectraBase Spectrum ID |
9CmzqOOpviq |
Name |
3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-4-(2-methylphenyl)-5-oxo-, 2-phenylethyl 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 |
401.199093730 u |
Formula |
C26H27NO3 |
InChI |
InChI=1S/C26H27NO3/c1-17-9-6-7-12-20(17)24-23(18(2)27-21-13-8-14-22(28)25(21)24)26(29)30-16-15-19-10-4-3-5-11-19/h3-7,9-12,24,27H,8,13-16H2,1-2H3 |
InChIKey |
WIEXPYWYJVVOBX-UHFFFAOYSA-N |
Molecular Weight |
401.506 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5997 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10211624; Lab Info: SAS; Lab Number: SAS-tst3303 |