| SpectraBase Spectrum ID |
HsSRpRCBdAK |
| Name |
Hexanenitrile, 5-methyl-2-(phenylthio)- |
| Alternate Name(s) |
5-Methyl-2-(phenylsulfanyl)hexanenitrile
5-Methyl-2-phenylthiohexanonitrile |
| CAS Registry Number |
66164-78-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17NS |
| InChI |
InChI=1S/C13H17NS/c1-11(2)8-9-13(10-14)15-12-6-4-3-5-7-12/h3-7,11,13H,8-9H2,1-2H3 |
| InChIKey |
HNHQYSXMIGTKTI-UHFFFAOYSA-N |
| Molecular Weight |
219.346 g/mol |
| SMILES |
C(#N)C(Sc1ccccc1)CCC(C)C |
| SPLASH |
splash10-03dl-4940000000-b1bedff9da0a8ad1f463 |
| Source of Spectrum |
KC-1977-20-2279 |
| Wiley ID |
1218976 |
