| SpectraBase Spectrum ID |
B8mtqibcXAe |
| Name |
2-(4-Methylphenylsulfonyl)methylthio-N-triphenylphosphoranylideneaniline |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
553.129908490 u |
| Formula |
C32H28NO2PS2 |
| InChI |
InChI=1S/C32H28NO2PS2/c1-26-21-23-30(24-22-26)38(34,35)25-37-32-20-12-11-19-31(32)33-36(27-13-5-2-6-14-27,28-15-7-3-8-16-28)29-17-9-4-10-18-29/h2-24H,25H2,1H3 |
| InChIKey |
OQTJIDLUVAVTOW-UHFFFAOYSA-N |
| Molecular Weight |
553.675 g/mol |
| SMILES |
C=1(N=P(C=2C=CC=CC2)(C=2C=CC=CC2)C2=CC=CC=C2)C(SCS(C=2C=CC(=CC2)C)(=O)=O)=CC=CC1 |
