| SpectraBase Spectrum ID |
6PfvrFaJoLi |
| Name |
N-[2-(2-Chloro-phenoxy)-ethyl]-2-methoxy-4-methylsulfanyl-benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
351.069592315 u |
| Formula |
C17H18ClNO3S |
| InChI |
InChI=1S/C17H18ClNO3S/c1-21-16-11-12(23-2)7-8-13(16)17(20)19-9-10-22-15-6-4-3-5-14(15)18/h3-8,11H,9-10H2,1-2H3,(H,19,20) |
| InChIKey |
CMSITTXSBBJMAO-UHFFFAOYSA-N |
| Molecular Weight |
351.848 g/mol |
| SMILES |
C1(=C(C=C(C=C1)SC)OC)C(=O)NCCOC1=CC=CC=C1Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92008 |
![N-[2-(2-Chloro-phenoxy)-ethyl]-2-methoxy-4-methylsulfanyl-benzamide](/api/spectrum/6PfvrFaJoLi/structure.png?h=300&w=458 "N-[2-(2-Chloro-phenoxy)-ethyl]-2-methoxy-4-methylsulfanyl-benzamide")
