| SpectraBase Spectrum ID |
9cmG0NQNNJB |
| Name |
2-[(3R,4S)-4-(4-Chlorophenyl)-1-methyl-piperidin-3-ylmethylsulfanyl]-ethanol |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H22ClNOS |
| InChI |
InChI=1S/C15H22ClNOS/c1-17-7-6-15(12-2-4-14(16)5-3-12)13(10-17)11-19-9-8-18/h2-5,13,15,18H,6-11H2,1H3/t13-,15-/m1/s1 |
| InChIKey |
LDBRVIYKYLJDPX-UKRRQHHQSA-N |
| Ionization Type |
EI |
| Molecular Weight |
299.860 g/mol |
| Optical Rotation |
[a]D25 = +81.6 (c = 0.26, CHCl3) |
| SMILES |
OCCSC[C@]1(CN(CC[C@@]1(c1ccc(cc1)Cl)[H])C)[H] |
| SPLASH |
splash10-106r-0490000000-157a9078890e10970ccb |
| Source of Spectrum |
US8153657B2 |
| Thin-Layer Chromatography |
Rf = 0.27 (EtOAc/Et3N, 10:1) |
| Wiley ID |
1845199 |
![2-[(3R,4S)-4-(4-Chlorophenyl)-1-methyl-piperidin-3-ylmethylsulfanyl]-ethanol](/api/spectrum/9cmG0NQNNJB/structure.png?h=300&w=458 "2-[(3R,4S)-4-(4-Chlorophenyl)-1-methyl-piperidin-3-ylmethylsulfanyl]-ethanol")
