| SpectraBase Spectrum ID |
u8rAUP2yel |
| Name |
3-quinolinecarboxylic acid, 4-(5-bromo-2-methoxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, 2-phenoxyethyl 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 |
511.099435936 u |
| Formula |
C26H26BrNO5 |
| InChI |
InChI=1S/C26H26BrNO5/c1-16-23(26(30)33-14-13-32-18-7-4-3-5-8-18)24(19-15-17(27)11-12-22(19)31-2)25-20(28-16)9-6-10-21(25)29/h3-5,7-8,11-12,15,24,28H,6,9-10,13-14H2,1-2H3 |
| InChIKey |
VVKSDFUYTNGRBC-UHFFFAOYSA-N |
| Molecular Weight |
512.400 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11265 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10252178; Lab Info: SAS; Lab Number: SAS-tst3789 |
| Temperature |
29.85 °C |
