| SpectraBase Spectrum ID |
GnIVKgKRed3 |
| Name |
2,2-difluoro-2-(phenylmethylthio)acetic acid ethyl ester |
| Alternate Name(s) |
2-(benzylthio)-2,2-difluoro-acetic acid ethyl ester
ethyl 2,2-bis(fluoranyl)-2-(phenylmethylsulfanyl)ethanoate
ethyl 2-benzylsulfanyl-2,2-difluoro-acetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12F2O2S |
| InChI |
InChI=1S/C11H12F2O2S/c1-2-15-10(14)11(12,13)16-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3 |
| InChIKey |
VGXAYBVSTTYUCL-UHFFFAOYSA-N |
| Molecular Weight |
246.272 g/mol |
| SMILES |
C(C(SCc1ccccc1)(F)F)(=O)OCC |
| SPLASH |
splash10-0006-9000000000-87bc18a3a659032c0266 |
| Source of Spectrum |
E2-49-177-6 |
| Wiley ID |
1555536 |
