| SpectraBase Spectrum ID |
7wsld4JxCpw |
| Name |
Butanethioic acid, 2-fluoro-3-methyl-, S-phenyl ester |
| Alternate Name(s) |
S-phenyl 2-fluoro-3-methyl(thiobutanoate)
S-phenyl 2-fluoro-3-methylbutanethioate |
| CAS Registry Number |
114805-79-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H13FOS |
| InChI |
InChI=1S/C11H13FOS/c1-8(2)10(12)11(13)14-9-6-4-3-5-7-9/h3-8,10H,1-2H3 |
| InChIKey |
KQBVMHHZSRIZKL-UHFFFAOYSA-N |
| Molecular Weight |
212.282 g/mol |
| SMILES |
C(Sc1ccccc1)(C(F)C(C)C)=O |
| SPLASH |
splash10-03di-0910000000-414067811035a803afc2 |
| Source of Spectrum |
F-46-7440-8 |
| Wiley ID |
1211143 |
