| SpectraBase Spectrum ID |
CSpHRaXNFIK |
| Name |
3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-[4-(methoxycarbonyl)phenyl]-2,7,7-trimethyl-5-oxo-, 2-propoxyethyl 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 |
455.230787781 u |
| Formula |
C26H33NO6 |
| InChI |
InChI=1S/C26H33NO6/c1-6-11-32-12-13-33-25(30)21-16(2)27-19-14-26(3,4)15-20(28)23(19)22(21)17-7-9-18(10-8-17)24(29)31-5/h7-10,22,27H,6,11-15H2,1-5H3 |
| InChIKey |
FAUPADMROLGKNG-UHFFFAOYSA-N |
| Molecular Weight |
455.551 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11487 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10261489; Lab Info: SAS; Lab Number: SAS-tst4009 |
| Temperature |
23.85 °C |
