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N-(4-methoxyphenyl)-N-methyl-2-oxoethanethioamide
SpectraBase Compound ID 5ORBgCNlaTU
InChI InChI=1S/C10H11NO2S/c1-11(10(14)7-12)8-3-5-9(13-2)6-4-8/h3-7H,1-2H3
InChIKey MRLYNFJQACMNNY-UHFFFAOYSA-N
Mol Weight 209.26 g/mol
Molecular Formula C10H11NO2S
Exact Mass 209.05105 g/mol
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Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3wV5ttYWUQy
Name N-(4-Methoxyphenyl)-N-methyl-2-oxoethanethioamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 209.051049770 u
Formula C10H11NO2S
InChI InChI=1S/C10H11NO2S/c1-11(10(14)7-12)8-3-5-9(13-2)6-4-8/h3-7H,1-2H3
InChIKey MRLYNFJQACMNNY-UHFFFAOYSA-N
Molecular Weight 209.263 g/mol
SMILES C(N(C=1C=CC(=CC1)OC)C)(=S)C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.90955
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