| SpectraBase Spectrum ID |
7osBjzKeNsw |
| Name |
3-ethyl-4-methyl-5-(methylthio)isothiazole |
| Alternate Name(s) |
3-ethyl-4-methyl-5-(methylsulfanyl)isothiazole
3-ethyl-4-methyl-5-isothiazolyl methyl sulfide |
| CAS Registry Number |
118631-16-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H11NS2 |
| InChI |
InChI=1S/C7H11NS2/c1-4-6-5(2)7(9-3)10-8-6/h4H2,1-3H3 |
| InChIKey |
SGIWMGFSAXPANV-UHFFFAOYSA-N |
| Molecular Weight |
173.292 g/mol |
| SMILES |
c1(c(snc1CC)SC)C |
| SPLASH |
splash10-05fr-0900000000-6108272d41fc87d4fcaa |
| Source of Spectrum |
J-54-1092-14 |
| Wiley ID |
1169636 |
