| SpectraBase Spectrum ID |
7W0Ltk6UVb6 |
| Name |
Butanenitrile, 4-(methylthio)- |
| CAS Registry Number |
59121-24-3 |
| Classification |
Nitriles |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
115.045570468 u |
| Formula |
C5H9NS |
| InChI |
InChI=1S/C5H9NS/c1-7-5-3-2-4-6/h2-3,5H2,1H3 |
| InChIKey |
JPWPMBYFDCHLKL-UHFFFAOYSA-N |
| Molecular Weight |
115.194 g/mol |
| Number of Peaks |
11 |
| SMILES |
C(CCCSC)#N |
| SPLASH |
splash10-03xr-9200000000-6ea66a2b837bf4326e28 |
| Source of Spectrum |
FF-18-150-150_2 (DOI: 10.1002/ffj.1163) |
| Synonyms |
4-(Methylthio)butanenitrile
4-(Methylsulfanyl)butanenitrile
4-(Methylthio)butyronitrile
3-(Methylthio)propyl cyanide
4-Methylthio butanenitrile
4-Methylthiobutyl nitrile
4-Methylsulfanylbutanenitrile |
| Wiley ID |
1775332 |
