| SpectraBase Spectrum ID |
FWhQGu3A40k |
| Name |
3-quinolinecarboxylic acid, 4-(4-ethoxyphenyl)-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-, 2-(1-methylethoxy)ethyl 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 |
441.251523226 u |
| Formula |
C26H35NO5 |
| InChI |
InChI=1S/C26H35NO5/c1-7-30-19-10-8-18(9-11-19)23-22(25(29)32-13-12-31-16(2)3)17(4)27-20-14-26(5,6)15-21(28)24(20)23/h8-11,16,23,27H,7,12-15H2,1-6H3 |
| InChIKey |
IIKLQMQUOQGFKK-UHFFFAOYSA-N |
| Molecular Weight |
441.568 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11293 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10252216; Lab Info: SAS; Lab Number: SAS-tst3827 |
| Temperature |
29.85 °C |
