SpectraBase Spectrum ID |
AbnUdoMgMk9 |
Name |
3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-, 2-ethoxyethyl 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 |
437.183837587 u |
Formula |
C25H27NO6 |
InChI |
InChI=1S/C25H27NO6/c1-4-30-10-11-31-25(29)21-15(3)26-18-6-5-7-19(27)23(18)22(21)17-13-32-20-9-8-14(2)12-16(20)24(17)28/h8-9,12-13,22,26H,4-7,10-11H2,1-3H3 |
InChIKey |
MPSUHUXDFJLAPF-UHFFFAOYSA-N |
Molecular Weight |
437.492 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_6747 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10220369; Lab Info: SAS; Lab Number: SAS-tst3361 |
Temperature |
29.85 °C |