| SpectraBase Spectrum ID |
F3ZucPE6bkf |
| Name |
acetic acid, [[3-cyano-1,4,5,6-tetrahydro-4-[4-(1-methylethyl)phenyl]-6-oxo-2-pyridinyl]thio]-, 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 |
372.150763812 u |
| Formula |
C20H24N2O3S |
| InChI |
InChI=1S/C20H24N2O3S/c1-12(2)14-5-7-15(8-6-14)16-9-18(23)22-20(17(16)10-21)26-11-19(24)25-13(3)4/h5-8,12-13,16H,9,11H2,1-4H3,(H,22,23) |
| InChIKey |
QVYWXVWAQKYFMQ-UHFFFAOYSA-N |
| Molecular Weight |
372.483 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8991 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9253208; Lab Info: KR; Lab Number: KR-0000062 |
![acetic acid, [[3-cyano-1,4,5,6-tetrahydro-4-[4-(1-methylethyl)phenyl]-6-oxo-2-pyridinyl]thio]-, 1-methylethyl ester](/api/spectrum/F3ZucPE6bkf/structure.png?h=300&w=458 "acetic acid, [[3-cyano-1,4,5,6-tetrahydro-4-[4-(1-methylethyl)phenyl]-6-oxo-2-pyridinyl]thio]-, 1-methylethyl ester")
