| SpectraBase Spectrum ID |
LuqjfeaUYWN |
| Name |
(E)-3-(difluoromethyl)-2,2-difluoro-3-hydroxy-1,5-diphenylpentyl-4-en-1-one |
| Appearance |
Light yellow oily |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H14F4O2 |
| InChI |
InChI=1S/C18H14F4O2/c19-16(20)17(24,12-11-13-7-3-1-4-8-13)18(21,22)15(23)14-9-5-2-6-10-14/h1-12,16,24H/b12-11+ |
| InChIKey |
RODLNGDHIVDAOQ-VAWYXSNFSA-N |
| Ionization Type |
EI |
| Molecular Weight |
338.302 g/mol |
| Optical Rotation |
[a]D25 = -79.1 (c = 0.45, MeOH) |
| Reported Formula |
C18H14O2F4 |
| SMILES |
OC(\C=C\c1ccccc1)(C(C(c1ccccc1)=O)(F)F)C(F)F |
| SPLASH |
splash10-0550-5519000000-d6f9b4520133fee24c19 |
| Sample Comments |
92% ee |
| Source of Spectrum |
CN102516152A |
| Wiley ID |
1844715 |
