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5-Chloro-5-(N-methlanilino)penta-2,4-dienal

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

5-Chloro-5-(N-methlanilino)penta-2,4-dienal
SpectraBase Compound ID ED1wWxQT8vo
InChI InChI=1S/C12H12ClNO/c1-14(11-7-3-2-4-8-11)12(13)9-5-6-10-15/h2-10H,1H3/b6-5+,12-9+
InChIKey UCLKBHDVFUZVGC-HFACTSAFSA-N
Mol Weight 221.69 g/mol
Molecular Formula C12H12ClNO
Exact Mass 221.060742 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B9Vwtp0VTE4
Name 5-Chloro-5-(N-methlanilino)penta-2,4-dienal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 221.060741709 u
Formula C12H12ClNO
InChI InChI=1S/C12H12ClNO/c1-14(11-7-3-2-4-8-11)12(13)9-5-6-10-15/h2-10H,1H3/b6-5+,12-9+
InChIKey UCLKBHDVFUZVGC-HFACTSAFSA-N
Molecular Weight 221.687 g/mol
SMILES C1(N(\C(=C\C=C\C=O)Cl)C)=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952385