| SpectraBase Spectrum ID |
ClwaNsuBtJI |
| Name |
7-Thia-1-phosphabicyclo[2.2.1]hept-5-ene-3-carbonitrile, 4,6-diphenyl-, 1-sulfide, exo- |
| CAS Registry Number |
98039-39-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H14NPS2 |
| InChI |
InChI=1S/C18H14NPS2/c19-12-16-13-20(21)17(14-7-3-1-4-8-14)11-18(16,22-20)15-9-5-2-6-10-15/h1-11,16H,13H2/t16-,18+,20-/m1/s1 |
| InChIKey |
HIPRYNJWBNVKQS-IMFGXOCKSA-N |
| Molecular Weight |
339.411 g/mol |
| SMILES |
[C@]12(S[P@](C[C@]2(C#N)[H])(C(=C1)c1ccccc1)=S)c1ccccc1 |
| SPLASH |
splash10-0udi-0090000000-ffa012aedd59d347cbe1 |
| Source of Spectrum |
AJ-58-673-16 |
| Synonyms |
4,6-diphenyl-7-thia-1-phosphabicyclo[2.2.1]hept-5-ene-3-carbonitrile 1-sulfide
exo-5-cyano-2,4-diphenyl-7-thia-1-phosphabicyclo[2.2.1]hept-2-ene 1-sulfide |
| Wiley ID |
1334438 |
![7-Thia-1-phosphabicyclo[2.2.1]hept-5-ene-3-carbonitrile, 4,6-diphenyl-, 1-sulfide, exo-](/api/spectrum/ClwaNsuBtJI/structure.png?h=300&w=458 "7-Thia-1-phosphabicyclo[2.2.1]hept-5-ene-3-carbonitrile, 4,6-diphenyl-, 1-sulfide, exo-")
