| SpectraBase Spectrum ID |
3JZYuL5LJL |
| Name |
3-(1,1-difluoro-2-oxo-2-phenyl ethyl)-3-hydroxy-1-methyl indol-2-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H13F2NO3 |
| InChI |
InChI=1S/C17H13F2NO3/c1-20-13-10-6-5-9-12(13)16(23,15(20)22)17(18,19)14(21)11-7-3-2-4-8-11/h2-10,23H,1H3 |
| InChIKey |
VSCPIDHBHYFTOI-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Molecular Weight |
317.292 g/mol |
| Optical Rotation |
[a]D25 = -105.5 (c = 0.58, MeOH) |
| Reported Formula |
C17H13NO3F2 |
| SMILES |
OC1(c2ccccc2N(C1=O)C)C(C(c1ccccc1)=O)(F)F |
| SPLASH |
splash10-03di-3900000000-702ef0ed68dbc817cfa3 |
| Sample Comments |
94% ee |
| Source of Spectrum |
CN102516152A |
| Wiley ID |
1844724 |
