| SpectraBase Spectrum ID |
e8xq4utuIJ |
| Name |
acetic acid, [[3-cyano-4-[4-(difluoromethoxy)phenyl]-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-, 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 |
382.079884499 u |
| Formula |
C17H16F2N2O4S |
| InChI |
InChI=1S/C17H16F2N2O4S/c1-2-24-15(23)9-26-16-13(8-20)12(7-14(22)21-16)10-3-5-11(6-4-10)25-17(18)19/h3-6,12,17H,2,7,9H2,1H3,(H,21,22) |
| InChIKey |
NOFBBFRNGCMREE-UHFFFAOYSA-N |
| Molecular Weight |
382.382 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_7739 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10231952; Lab Info: KR; Lab Number: KR-KC03359 |
| Temperature |
23.85 °C |
![acetic acid, [[3-cyano-4-[4-(difluoromethoxy)phenyl]-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-, ethyl ester](/api/spectrum/e8xq4utuIJ/structure.png?h=300&w=458 "acetic acid, [[3-cyano-4-[4-(difluoromethoxy)phenyl]-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-, ethyl ester")
