| SpectraBase Spectrum ID |
3EKLfJjKAtD |
| Name |
N-(benzyloxy)-2-((4-chlorophenyl)sulfinyl)-2-methylpropanamide |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
351.069592315 u |
| Formula |
C17H18ClNO3S |
| InChI |
InChI=1S/C17H18ClNO3S/c1-17(2,23(21)15-10-8-14(18)9-11-15)16(20)19-22-12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,19,20) |
| InChIKey |
BSLNXLPARWDKAN-UHFFFAOYSA-N |
| Instrument Name |
Water Q-ToF-Micro Micromass |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.2c02274 |
| Molecular Weight |
351.848 g/mol |
| Quality |
13 |
| Reported Formula |
C17H18NO3SCl |
| SMILES |
N(C(C(S(C=1C=CC(=CC1)Cl)=O)(C)C)=O)OCC1=CC=CC=C1 |
| SPLASH |
splash10-0006-0910000000-c7aa843261df3d12983d |
| Source of Spectrum |
JOC-88-SM26-9 (DOI: 10.1021/acs.joc.2c02274) |
| Thin-Layer Chromatography |
0.4 (EtOAc/hexanes, 25:75) |
| Wiley ID |
1912626 |
