| SpectraBase Spectrum ID |
3CkIb8c8Jv6 |
| Name |
3-pyridinecarbonitrile, 1,4,5,6-tetrahydro-2-(methylthio)-4-(3-nitrophenyl)-6-oxo- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.052112397 u |
| Formula |
C13H11N3O3S |
| InChI |
InChI=1S/C13H11N3O3S/c1-20-13-11(7-14)10(6-12(17)15-13)8-3-2-4-9(5-8)16(18)19/h2-5,10H,6H2,1H3,(H,15,17) |
| InChIKey |
JRCMYKQFTZWLKD-UHFFFAOYSA-N |
| Molecular Weight |
289.309 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_1921 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8156101; Lab Info: KR; Lab Number: KR-ug00230 |
| Temperature |
29.85 °C |
