| SpectraBase Spectrum ID |
LG3gJmHP3qm |
| Name |
2-propenenitrile, 3-[(2,5-dimethylphenyl)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 |
452.102848433 u |
| Formula |
C24H21FN2O2S2 |
| InChI |
InChI=1S/C24H21FN2O2S2/c1-17-11-12-18(2)22(13-17)27-24(30-16-19-7-6-8-20(25)14-19)23(15-26)31(28,29)21-9-4-3-5-10-21/h3-14,27H,16H2,1-2H3/b24-23+ |
| InChIKey |
PFPRSGJWAFGYHU-WCWDXBQESA-N |
| Molecular Weight |
452.562 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_4456 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13288070 |
![2-propenenitrile, 3-[(2,5-dimethylphenyl)amino]-3-[[(3-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-, (2E)-](/api/spectrum/LG3gJmHP3qm/structure.png?h=300&w=458 "2-propenenitrile, 3-[(2,5-dimethylphenyl)amino]-3-[[(3-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-, (2E)-")
