| SpectraBase Spectrum ID |
39wfvbuXMoE |
| Name |
2-propenenitrile, 3-[(2-chlorophenyl)amino]-3-[[[4-(1,1-dimethylethyl)phenyl]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 |
496.104598099 u |
| Formula |
C26H25ClN2O2S2 |
| InChI |
InChI=1S/C26H25ClN2O2S2/c1-26(2,3)20-15-13-19(14-16-20)18-32-25(29-23-12-8-7-11-22(23)27)24(17-28)33(30,31)21-9-5-4-6-10-21/h4-16,29H,18H2,1-3H3/b25-24+ |
| InChIKey |
RAWQKOVOWRFYPN-OCOZRVBESA-N |
| Molecular Weight |
497.071 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_4407 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13288011 |
![2-propenenitrile, 3-[(2-chlorophenyl)amino]-3-[[[4-(1,1-dimethylethyl)phenyl]methyl]thio]-2-(phenylsulfonyl)-, (2E)-](/api/spectrum/39wfvbuXMoE/structure.png?h=300&w=458 "2-propenenitrile, 3-[(2-chlorophenyl)amino]-3-[[[4-(1,1-dimethylethyl)phenyl]methyl]thio]-2-(phenylsulfonyl)-, (2E)-")
