| SpectraBase Spectrum ID |
35ei6EM1a8z |
| Name |
3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-4-(3-phenoxyphenyl)-, propyl 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 |
417.194008349 u |
| Formula |
C26H27NO4 |
| InChI |
InChI=1S/C26H27NO4/c1-3-15-30-26(29)23-17(2)27-21-13-8-14-22(28)25(21)24(23)18-9-7-12-20(16-18)31-19-10-5-4-6-11-19/h4-7,9-12,16,24,27H,3,8,13-15H2,1-2H3 |
| InChIKey |
OUTCKCXNICFCNE-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_11196 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10251666; Lab Info: SAS; Lab Number: SAS-tst3703 |
| Temperature |
29.85 °C |
