| SpectraBase Spectrum ID |
1u8j0ctxNB9 |
| Name |
acetic acid, [[3-cyano-1,4,5,6-tetrahydro-4-(2-methoxyphenyl)-6-oxo-2-pyridinyl]thio]-, methyl 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 |
332.083078173 u |
| Formula |
C16H16N2O4S |
| InChI |
InChI=1S/C16H16N2O4S/c1-21-13-6-4-3-5-10(13)11-7-14(19)18-16(12(11)8-17)23-9-15(20)22-2/h3-6,11H,7,9H2,1-2H3,(H,18,19) |
| InChIKey |
NXYDQNQEOTVWTM-UHFFFAOYSA-N |
| Molecular Weight |
332.374 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_223 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8015836; Lab Info: KR; Lab Number: KR-lug0100 |
| Temperature |
29.85 °C |
![acetic acid, [[3-cyano-1,4,5,6-tetrahydro-4-(2-methoxyphenyl)-6-oxo-2-pyridinyl]thio]-, methyl ester](/api/spectrum/1u8j0ctxNB9/structure.png?h=300&w=458 "acetic acid, [[3-cyano-1,4,5,6-tetrahydro-4-(2-methoxyphenyl)-6-oxo-2-pyridinyl]thio]-, methyl ester")
