| SpectraBase Spectrum ID |
6fFQMdXaguP |
| Name |
3-quinolinecarboxylic acid, 4-(6-bromo-1,3-benzodioxol-5-yl)-1,4,5,6,7,8-hexahydro-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 |
519.125650684 u |
| Formula |
C25H30BrNO6 |
| InChI |
InChI=1S/C25H30BrNO6/c1-5-6-30-7-8-31-24(29)21-14(2)27-17-11-25(3,4)12-18(28)23(17)22(21)15-9-19-20(10-16(15)26)33-13-32-19/h9-10,22,27H,5-8,11-13H2,1-4H3 |
| InChIKey |
IZZZJWPRMBYLHR-UHFFFAOYSA-N |
| Molecular Weight |
520.420 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11375 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10261377; Lab Info: SAS; Lab Number: SAS-tst3955 |
