SpectraBase Spectrum ID |
KWl0K8wzIDA |
Name |
3-pyridinecarboxylic acid, 4-(2-bromo-3,4,5-trimethoxyphenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, 1-methylethyl 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 |
441.078700491 u |
Formula |
C19H24BrNO6 |
InChI |
InChI=1S/C19H24BrNO6/c1-9(2)27-19(23)15-10(3)21-14(22)8-11(15)12-7-13(24-4)17(25-5)18(26-6)16(12)20/h7,9,11H,8H2,1-6H3,(H,21,22) |
InChIKey |
SQABHXFPYWKQBA-UHFFFAOYSA-N |
Molecular Weight |
442.306 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_9312 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10240429; Lab Info: SAS; Lab Number: SAS-tst3616 |
Temperature |
23.85 °C |