| SpectraBase Spectrum ID |
1veT84Kztka |
| Name |
3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-4-(5-methyl-2-thienyl)-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 |
435.186814969 u |
| Formula |
C26H29NO3S |
| InChI |
InChI=1S/C26H29NO3S/c1-16-10-11-21(31-16)24-22(25(29)30-13-12-18-8-6-5-7-9-18)17(2)27-19-14-26(3,4)15-20(28)23(19)24/h5-11,24,27H,12-15H2,1-4H3 |
| InChIKey |
VSMDTURROHSZGZ-UHFFFAOYSA-N |
| Molecular Weight |
435.582 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11173 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10251627; Lab Info: SAS; Lab Number: SAS-tst3662 |
| Temperature |
29.85 °C |
