| SpectraBase Spectrum ID |
3yYAatMBvVX |
| Name |
(R)-2-hydroxy-1,4-diphenyl-2-(trifluoromethyl)but-3-yn-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.071114081 u |
| Formula |
C17H11F3O2 |
| InChI |
InChI=1S/C17H11F3O2/c18-17(19,20)16(22,12-11-13-7-3-1-4-8-13)15(21)14-9-5-2-6-10-14/h1-10,22H/t16-/m1/s1 |
| InChIKey |
QQOQVVKFKCWIIU-MRXNPFEDSA-N |
| Instrument Name |
Agilent 7890A-5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201501044 |
| Molecular Weight |
304.268 g/mol |
| Optical Rotation |
[a]D(rt) = +55.8 (c = 0.8, CH2Cl2) |
| Quality |
190 |
| Reported Formula |
C17H11O2F3 |
| SMILES |
O[C@](C#CC=1C=CC=CC1)(C(C1=CC=CC=C1)=O)C(F)(F)F |
| SPLASH |
splash10-0a6r-3900000000-9c212948aa96ad9822e6 |
| Sample Comments |
99% ee |
| Source of Spectrum |
QE-21-SM6-4g (DOI: 10.1002/chem.201501044) |
| Wiley ID |
1906605 |
