| SpectraBase Spectrum ID |
IpquiYTOeQ2 |
| Name |
3-pyridinecarbonitrile, 1,4,5,6-tetrahydro-2-[[(4-methylphenyl)methyl]thio]-6-oxo-4-phenyl- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.113984381 u |
| Formula |
C20H18N2OS |
| InChI |
InChI=1S/C20H18N2OS/c1-14-7-9-15(10-8-14)13-24-20-18(12-21)17(11-19(23)22-20)16-5-3-2-4-6-16/h2-10,17H,11,13H2,1H3,(H,22,23) |
| InChIKey |
HEQXZLOWMXQJEZ-UHFFFAOYSA-N |
| Molecular Weight |
334.437 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_226 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8016211; Lab Info: KR; Lab Number: KR-lug0272 |
| Temperature |
29.85 °C |
![3-pyridinecarbonitrile, 1,4,5,6-tetrahydro-2-[[(4-methylphenyl)methyl]thio]-6-oxo-4-phenyl-](/api/spectrum/IpquiYTOeQ2/structure.png?h=300&w=458 "3-pyridinecarbonitrile, 1,4,5,6-tetrahydro-2-[[(4-methylphenyl)methyl]thio]-6-oxo-4-phenyl-")
