SpectraBase Spectrum ID |
IDK1G8CG9IZ |
Name |
3-quinolinecarboxylic acid, 4-(5-bromo-2-methoxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, methyl 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 |
405.057571124 u |
Formula |
C19H20BrNO4 |
InChI |
InChI=1S/C19H20BrNO4/c1-10-16(19(23)25-3)17(12-9-11(20)7-8-15(12)24-2)18-13(21-10)5-4-6-14(18)22/h7-9,17,21H,4-6H2,1-3H3 |
InChIKey |
GQTAKHZAYOMMGM-UHFFFAOYSA-N |
Molecular Weight |
406.276 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_11228 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10251723; Lab Info: SAS; Lab Number: SAS-tst3764 |
Temperature |
29.85 °C |