| SpectraBase Spectrum ID |
61e3HMrfOnB |
| Name |
3-quinolinecarboxylic acid, 4-(3-fluorophenyl)-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-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 |
433.205321926 u |
| Formula |
C27H28FNO3 |
| InChI |
InChI=1S/C27H28FNO3/c1-17-23(26(31)32-13-12-18-8-5-4-6-9-18)24(19-10-7-11-20(28)14-19)25-21(29-17)15-27(2,3)16-22(25)30/h4-11,14,24,29H,12-13,15-16H2,1-3H3 |
| InChIKey |
WQWIPDQACZGAQA-UHFFFAOYSA-N |
| Molecular Weight |
433.523 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11262 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10252173; Lab Info: SAS; Lab Number: SAS-tst3784 |
