| SpectraBase Spectrum ID |
H7ccGqWhpgE |
| Name |
Pentanenitrile, 5-(methylthio)- |
| CAS Registry Number |
59121-25-4 |
| Classification |
Nitriles |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
129.061220532 u |
| Formula |
C6H11NS |
| InChI |
InChI=1S/C6H11NS/c1-8-6-4-2-3-5-7/h2-4,6H2,1H3 |
| InChIKey |
XPUDGEZWSNPCMM-UHFFFAOYSA-N |
| Molecular Weight |
129.221 g/mol |
| Number of Peaks |
15 |
| SMILES |
C(CCCCSC)#N |
| SPLASH |
splash10-03di-9200000000-16c01e9507fcb28c9c39 |
| Source of Spectrum |
FF-18-150-150_4 (DOI: 10.1002/ffj.1163) |
| Synonyms |
5-(Methylthio)pentanenitrile
5-(Methylsulfanyl)pentanenitrile
1-Cyano-4-(methylthio)butane
5-(Methylthio)valeronitrile
4-(Methylthio)butyl cyanide
5-Methylthiopentanonitrile
5-Methylthiopentyl nitrile
5-Methylsulfanylpentanenitrile |
| Wiley ID |
1775333 |
