| SpectraBase Spectrum ID |
DGJPxRkiMxA |
| Name |
2-propenenitrile, 3-[(3-chloro-2-methylphenyl)amino]-3-[[(3-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-, (2E)- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
472.048226037 u |
| Formula |
C23H18ClFN2O2S2 |
| InChI |
InChI=1S/C23H18ClFN2O2S2/c1-16-20(24)11-6-12-21(16)27-23(30-15-17-7-5-8-18(25)13-17)22(14-26)31(28,29)19-9-3-2-4-10-19/h2-13,27H,15H2,1H3/b23-22+ |
| InChIKey |
KFWNOQYSISZXIZ-GHVJWSGMSA-N |
| Molecular Weight |
472.980 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_4096 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13279593 |
![2-propenenitrile, 3-[(3-chloro-2-methylphenyl)amino]-3-[[(3-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-, (2E)-](/api/spectrum/DGJPxRkiMxA/structure.png?h=300&w=458 "2-propenenitrile, 3-[(3-chloro-2-methylphenyl)amino]-3-[[(3-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-, (2E)-")
