| SpectraBase Spectrum ID |
Jiwom1DHPi4 |
| Name |
(2S,3R)-4,4,4-trifluoro-3-hydroxy-3-methyl-2-(2-naphthylmethyl)butanal |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
296.102414210 u |
| Formula |
C16H15F3O2 |
| InChI |
InChI=1S/C16H15F3O2/c1-15(21,16(17,18)19)14(10-20)9-11-6-7-12-4-2-3-5-13(12)8-11/h2-8,10,14,21H,9H2,1H3/t14-,15-/m1/s1 |
| InChIKey |
GZRKTBYFPIHKJP-HUUCEWRRSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202208861 |
| Molecular Weight |
296.289 g/mol |
| Optical Rotation |
[a]D20 = 10.8 (c = 0.10, CHCl3) |
| Quality |
59 |
| Reported Formula |
C16H15O2F3 |
| SMILES |
O[C@@]([C@](CC=1C=CC=2C=CC=CC2C1)(C=O)[H])(C)C(F)(F)F |
| SPLASH |
splash10-0007-0920000000-e52b9692df76b4d6dc1c |
| Sample Comments |
dr = 5:1, |
| Source of Spectrum |
ACI-61-SM17-9 (DOI: 10.1002/anie.202208861) |
| Wiley ID |
1899473 |
