| SpectraBase Spectrum ID |
J3bT1i8dhlA |
| Name |
(2R)-2-hydroxy-1-(2-thienyl)-2-(trifluoromethyl)-4-triisopropylsilyl-but-3-yn-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
390.129662241 u |
| Formula |
C18H25F3O2SSi |
| InChI |
InChI=1S/C18H25F3O2SSi/c1-12(2)25(13(3)4,14(5)6)11-9-17(23,18(19,20)21)16(22)15-8-7-10-24-15/h7-8,10,12-14,23H,1-6H3/t17-/m1/s1 |
| InChIKey |
VWYQISNIGAWRFL-QGZVFWFLSA-N |
| Instrument Name |
Agilent 7890A-5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201501044 |
| Molecular Weight |
390.536 g/mol |
| Optical Rotation |
[a]D(rt) = +41.1 (c = 1.0, CH2Cl2) |
| Quality |
67 |
| Reported Formula |
C18H25O2F3SSi |
| SMILES |
O[C@](C#C[Si](C(C)C)(C(C)C)C(C)C)(C(C1=CC=CS1)=O)C(F)(F)F |
| SPLASH |
splash10-03di-0901000000-9cd503df64f894c770b9 |
| Sample Comments |
89% ee |
| Source of Spectrum |
QE-21-SM3-4c (DOI: 10.1002/chem.201501044) |
| Wiley ID |
1906601 |
