| SpectraBase Spectrum ID |
4nJ7uKkJ0EX |
| Name |
5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-4-(4-methylphenyl)-2-oxo-, 2-(methylthio)ethyl 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 |
320.119463683 u |
| Formula |
C16H20N2O3S |
| InChI |
InChI=1S/C16H20N2O3S/c1-10-4-6-12(7-5-10)14-13(11(2)17-16(20)18-14)15(19)21-8-9-22-3/h4-7,14H,8-9H2,1-3H3,(H2,17,18,20) |
| InChIKey |
NCKJPDLWDVILNU-UHFFFAOYSA-N |
| Molecular Weight |
320.407 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7106387; Lab Info: SAS; Lab Number: SAS-0006138 |
| Temperature |
29.85 °C |
