| SpectraBase Spectrum ID |
4BTHdoEoU4l |
| Name |
2-propenenitrile, 3-[(3-chlorophenyl)amino]-3-[[(2-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 |
458.032575972 u |
| Formula |
C22H16ClFN2O2S2 |
| InChI |
InChI=1S/C22H16ClFN2O2S2/c23-17-8-6-9-18(13-17)26-22(29-15-16-7-4-5-12-20(16)24)21(14-25)30(27,28)19-10-2-1-3-11-19/h1-13,26H,15H2/b22-21+ |
| InChIKey |
VTHSVXCKHGOBFB-QURGRASLSA-N |
| Molecular Weight |
458.953 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_4101 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13279598 |
![2-propenenitrile, 3-[(3-chlorophenyl)amino]-3-[[(2-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-, (2E)-](/api/spectrum/4BTHdoEoU4l/structure.png?h=300&w=458 "2-propenenitrile, 3-[(3-chlorophenyl)amino]-3-[[(2-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-, (2E)-")
