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Acetamide, 2-(3,5-dimethylbenzylthio)-N-(3-pyridylmethyl)-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Acetamide, 2-(3,5-dimethylbenzylthio)-N-(3-pyridylmethyl)-
SpectraBase Compound ID 2mDEgivpCmV
InChI InChI=1S/C17H20N2OS/c1-13-6-14(2)8-16(7-13)11-21-12-17(20)19-10-15-4-3-5-18-9-15/h3-9H,10-12H2,1-2H3,(H,19,20)
InChIKey DFBWSMOZBNYFIC-UHFFFAOYSA-N
Mol Weight 300.42 g/mol
Molecular Formula C17H20N2OS
Exact Mass 300.129634 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KkcHuM3xSr4
Name Acetamide, 2-(3,5-dimethylbenzylthio)-N-(3-pyridylmethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.129634445 u
Formula C17H20N2OS
InChI InChI=1S/C17H20N2OS/c1-13-6-14(2)8-16(7-13)11-21-12-17(20)19-10-15-4-3-5-18-9-15/h3-9H,10-12H2,1-2H3,(H,19,20)
InChIKey DFBWSMOZBNYFIC-UHFFFAOYSA-N
SMILES C(NCC1=CC=CN=C1)(=O)CSCC1=CC(C)=CC(C)=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.890109