| SpectraBase Spectrum ID |
CbMLE6KEyFK |
| Name |
N-[2'-(Phenylthio)-2'-phenylethyl]-3,4-dimethoxyphenyl-acetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
407.155514840 u |
| Formula |
C24H25NO3S |
| InChI |
InChI=1S/C24H25NO3S/c1-27-21-14-13-18(15-22(21)28-2)16-24(26)25-17-23(19-9-5-3-6-10-19)29-20-11-7-4-8-12-20/h3-15,23H,16-17H2,1-2H3,(H,25,26) |
| InChIKey |
BQKJLCZRPJZEHA-UHFFFAOYSA-N |
| Molecular Weight |
407.528 g/mol |
| SMILES |
C(SC=1C=CC=CC1)(CNC(=O)CC=1C=C(OC)C(=CC1)OC)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885458 |
![N-[2'-(Phenylthio)-2'-phenylethyl]-3,4-dimethoxyphenyl-acetamide](/api/spectrum/CbMLE6KEyFK/structure.png?h=300&w=458 "N-[2'-(Phenylthio)-2'-phenylethyl]-3,4-dimethoxyphenyl-acetamide")
