| SpectraBase Spectrum ID |
1OScIxuQj5a |
| Name |
2-[(3R,4S)-4-(4-Chlorophenyl)-1-methyl-piperidin-3-ylmethylsulfanyl]-N-hydroxy-acetamide |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H21ClN2O2S |
| InChI |
InChI=1S/C15H21ClN2O2S/c1-18-7-6-14(11-2-4-13(16)5-3-11)12(8-18)9-21-10-15(19)17-20/h2-5,12,14,20H,6-10H2,1H3,(H,17,19)/t12-,14-/m1/s1 |
| InChIKey |
IHULPNQTAMHLJL-TZMCWYRMSA-N |
| Ionization Type |
EI |
| Molecular Weight |
328.858 g/mol |
| Optical Rotation |
[a]D25 = +27.8 (c = 0.37, CH3OH) |
| Reported Formula |
C15H21ClN2O2S |
| SMILES |
N(C(CSC[C@]1(CN(CC[C@@]1(c1ccc(cc1)Cl)[H])C)[H])=O)O |
| SPLASH |
splash10-0v4i-0890000000-463dfea284d078e24c8b |
| Source of Spectrum |
US8153657B2 |
| Thin-Layer Chromatography |
Rf = 0.18 (EtOAc/MeOH/Et3N, 6:2:2) |
| Wiley ID |
1845228 |
![2-[(3R,4S)-4-(4-Chlorophenyl)-1-methyl-piperidin-3-ylmethylsulfanyl]-N-hydroxy-acetamide](/api/spectrum/1OScIxuQj5a/structure.png?h=300&w=458 "2-[(3R,4S)-4-(4-Chlorophenyl)-1-methyl-piperidin-3-ylmethylsulfanyl]-N-hydroxy-acetamide")
