| SpectraBase Spectrum ID |
76V3UKlAl1K |
| Name |
5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(3-hydroxyphenyl)-6-methyl-2-oxo-, 2-(ethylthio)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 |
336.114378302 u |
| Formula |
C16H20N2O4S |
| InChI |
InChI=1S/C16H20N2O4S/c1-3-23-8-7-22-15(20)13-10(2)17-16(21)18-14(13)11-5-4-6-12(19)9-11/h4-6,9,14,19H,3,7-8H2,1-2H3,(H2,17,18,21) |
| InChIKey |
GDOHSRZSQVNKNA-UHFFFAOYSA-N |
| Molecular Weight |
336.406 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_106 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7112969; Lab Info: SAS; Lab Number: SAS-0007122 |
| Temperature |
29.85 °C |
