| SpectraBase Spectrum ID |
6NAd0LAtNXe |
| Name |
(2RS,3SR,4RS)-3-Acetoxy-6-(2-hydroxyphenyl)-2-trifluoromethyl-3,6-dihydro-2H-thiopyran |
| Appearance |
Colorless needles |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.053749939 u |
| Formula |
C14H13F3O3S |
| InChI |
InChI=1S/C14H13F3O3S/c1-8(18)20-11-6-7-12(21-13(11)14(15,16)17)9-4-2-3-5-10(9)19/h2-7,11-13,19H,1H3/t11-,12+,13+/m0/s1 |
| InChIKey |
ZKDBHJGAZCZIGB-YNEHKIRRSA-N |
| Instrument Name |
Hewlett-Packard 5890/5972 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800643 |
| Molecular Weight |
318.310 g/mol |
| Quality |
159 |
| SMILES |
OC=1C([C@]2(C=C[C@@]([C@@](S2)(C(F)(F)F)[H])(OC(C)=O)[H])[H])=CC=CC1 |
| SPLASH |
splash10-000i-4930000000-156c6a51d9033f1e592a |
| Source of Spectrum |
K1-2018-5582-17 (DOI: 10.1002/ejoc.201800643) |
| Thin-Layer Chromatography |
0.50 (EtOAc/hexane, 1:5) |
| Wiley ID |
1894344 |
