| SpectraBase Spectrum ID |
7DNW84BlTZM |
| Name |
(1S,2R)-2-Phenoxy-2-phenyl-1-(thiophen-2-yl)-ethanol |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
296.087100927 u |
| Formula |
C18H16O2S |
| InChI |
InChI=1S/C18H16O2S/c19-17(16-12-7-13-21-16)18(14-8-3-1-4-9-14)20-15-10-5-2-6-11-15/h1-13,17-19H/t17-,18-/m1/s1 |
| InChIKey |
ONFVQBNBCHQMBB-QZTJIDSGSA-N |
| Instrument Name |
Agilent 6890N/5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201602254 |
| Molecular Weight |
296.384 g/mol |
| Quality |
98 |
| Reported Formula |
C18H16O2S |
| SMILES |
O[C@@]([C@](OC1=CC=CC=C1)(C=1C=CC=CC1)[H])(C=1SC=CC1)[H] |
| SPLASH |
splash10-001i-1900000000-30729b4885a6825fb5ff |
| Sample Comments |
Major diastereoisomer, dr = (17:1) |
| Source of Spectrum |
QE-22-SM12-syn-6af (DOI: 10.1002/chem.201602254) |
| Thin-Layer Chromatography |
0.32 (hexane/EtOAc, 20:1) |
| Wiley ID |
1905238 |
