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N-(1-(4-Methoxy-3-methylphenyl)butan-2-yl)acetamide
SpectraBase Compound ID CW3NJdvc3yy
InChI InChI=1S/C14H21NO2/c1-5-13(15-11(3)16)9-12-6-7-14(17-4)10(2)8-12/h6-8,13H,5,9H2,1-4H3,(H,15,16)
InChIKey HGWKCSTYVPGALO-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5yXyXWLUyqb
Name N-(1-(4-Methoxy-3-methylphenyl)butan-2-yl)acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.157228918 u
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-5-13(15-11(3)16)9-12-6-7-14(17-4)10(2)8-12/h6-8,13H,5,9H2,1-4H3,(H,15,16)
InChIKey HGWKCSTYVPGALO-UHFFFAOYSA-N
Molecular Weight 235.327 g/mol
SMILES C1=C(C(=CC(=C1)CC(NC(C)=O)CC)C)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.978434