| SpectraBase Spectrum ID |
6HWSc9XOHhp |
| Name |
Hexanenitrile, 5-hydroxy-6-(propylthio)- |
| Alternate Name(s) |
5-hydroxy-6-(propylsulfanyl)hexanenitrile
5-Hydroxy-6-(propylthio)hexanenitrile |
| CAS Registry Number |
108078-61-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H17NOS |
| InChI |
InChI=1S/C9H17NOS/c1-2-7-12-8-9(11)5-3-4-6-10/h9,11H,2-5,7-8H2,1H3 |
| InChIKey |
KYPSMGGMTMTNSU-UHFFFAOYSA-N |
| Molecular Weight |
187.301 g/mol |
| SMILES |
OC(CCCC#N)CSCCC |
| SPLASH |
splash10-0a4i-0900000000-6a8dbf4a17ef5ae20d75 |
| Source of Spectrum |
KC-1988-2528-29 |
| Wiley ID |
1183728 |
