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3-(4-Aminophenyl)-N-methylpropanamide
SpectraBase Compound ID A7Qvt0b4HCa
InChI InChI=1S/C10H14N2O/c1-12-10(13)7-4-8-2-5-9(11)6-3-8/h2-3,5-6H,4,7,11H2,1H3,(H,12,13)
InChIKey XDIZSQMXCUSTBN-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C10H14N2O
Exact Mass 178.110613 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID A9EJT7Rgzf
Name 3-(4-Aminophenyl)-N-methylpropanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.110613078 u
Formula C10H14N2O
InChI InChI=1S/C10H14N2O/c1-12-10(13)7-4-8-2-5-9(11)6-3-8/h2-3,5-6H,4,7,11H2,1H3,(H,12,13)
InChIKey XDIZSQMXCUSTBN-UHFFFAOYSA-N
Molecular Weight 178.235 g/mol
SMILES C(NC)(CCC1=CC=C(C=C1)N)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.902216