| SpectraBase Spectrum ID |
4DRT4rFmkLF |
| Name |
2-(4-tert-butyl-1,3-thiazol-2-yl)acetonitrile |
| Alternate Name(s) |
2-(4-tert-butyl-1,3-thiazol-2-yl)ethanenitrile
2-(4-tert-butyl-2-thiazolyl)acetonitrile
2-(4-tert-butylthiazol-2-yl)acetonitrile |
| CAS Registry Number |
79455-62-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H12N2S |
| InChI |
InChI=1S/C9H12N2S/c1-9(2,3)7-6-12-8(11-7)4-5-10/h6H,4H2,1-3H3 |
| InChIKey |
UQISVQVOVFZPGU-UHFFFAOYSA-N |
| Molecular Weight |
180.269 g/mol |
| SMILES |
c1(nc(sc1)CC#N)C(C)(C)C |
| SPLASH |
splash10-001i-0900000000-e3b5bd02c9a3978e8407 |
| Source of Spectrum |
KC-1985-1625-9 |
| Wiley ID |
1175995 |
