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2-(4-Methylphenyl)-N-propyl-2-oxo-ethanimine

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

2-(4-Methylphenyl)-N-propyl-2-oxo-ethanimine
SpectraBase Compound ID KzhDgPCvlLm
InChI InChI=1S/C12H15NO/c1-3-8-13-9-12(14)11-6-4-10(2)5-7-11/h4-7,9H,3,8H2,1-2H3/b13-9+
InChIKey OTDCOKNSJUDJOF-UKTHLTGXSA-N
Mol Weight 189.26 g/mol
Molecular Formula C12H15NO
Exact Mass 189.115364 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6toZ1UkjjJY
Name 2-(4-Methylphenyl)-N-propyl-2-oxo-ethanimine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 189.115364106 u
Formula C12H15NO
InChI InChI=1S/C12H15NO/c1-3-8-13-9-12(14)11-6-4-10(2)5-7-11/h4-7,9H,3,8H2,1-2H3/b13-9+
InChIKey OTDCOKNSJUDJOF-UKTHLTGXSA-N
Molecular Weight 189.258 g/mol
SMILES C=1(C(\C=N\CCC)=O)C=CC(=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.857578