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5,5-bis[4-Chlorophenyl]penta-2,4-dienoic acid N,N-diethylamide
SpectraBase Compound ID 2T49W9pyumg
InChI InChI=1S/C21H21Cl2NO/c1-3-24(4-2)21(25)7-5-6-20(16-8-12-18(22)13-9-16)17-10-14-19(23)15-11-17/h5-15H,3-4H2,1-2H3/b7-5+
InChIKey SLZPFZNTYUSEJZ-FNORWQNLSA-N
Mol Weight 374.31 g/mol
Molecular Formula C21H21Cl2NO
Exact Mass 373.10002 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DmoGbfYK7nE
Name 5,5-bis[4-Chlorophenyl]penta-2,4-dienoic acid N,N-diethylamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.100019699 u
Formula C21H21Cl2NO
InChI InChI=1S/C21H21Cl2NO/c1-3-24(4-2)21(25)7-5-6-20(16-8-12-18(22)13-9-16)17-10-14-19(23)15-11-17/h5-15H,3-4H2,1-2H3/b7-5+
InChIKey SLZPFZNTYUSEJZ-FNORWQNLSA-N
Molecular Weight 374.311 g/mol
SMILES C1(=CC=C(C=C1)Cl)C(C1=CC=C(C=C1)Cl)=C\C=C\C(N(CC)CC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.883267