| SpectraBase Spectrum ID |
LwBCVfF8Bej |
| Name |
3-(4-fluorophenyl)-3-(phenylthio)propanoic acid |
| Alternate Name(s) |
3-(4-fluorophenyl)-3-(phenylthio)propionic acid
3-(4-fluorophenyl)-3-phenylsulfanylpropanoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H13FO2S |
| InChI |
InChI=1S/C15H13FO2S/c16-12-8-6-11(7-9-12)14(10-15(17)18)19-13-4-2-1-3-5-13/h1-9,14H,10H2,(H,17,18) |
| InChIKey |
PYBNVNFGWCGXRE-UHFFFAOYSA-N |
| Molecular Weight |
276.325 g/mol |
| SMILES |
OC(CC(Sc1ccccc1)c1ccc(cc1)F)=O |
| SPLASH |
splash10-004i-0910000000-71d4ee7ea8455ffda678 |
| Source of Spectrum |
SK-25-1503-2 |
| Wiley ID |
866693 |
