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(2E,6E)-4-[(E)-but-2-enyl]-N,N-diethyl-octa-2,6-dienamide
SpectraBase Compound ID 2GKZvQ1zIqg
InChI InChI=1S/C16H27NO/c1-5-9-11-15(12-10-6-2)13-14-16(18)17(7-3)8-4/h5-6,9-10,13-15H,7-8,11-12H2,1-4H3/b9-5+,10-6+,14-13+
InChIKey PKZWYAPRDBSUCI-WONASCPISA-N
Mol Weight 249.4 g/mol
Molecular Formula C16H27NO
Exact Mass 249.209264 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7Vey0SvUTG2
Name (2E,6E)-4-[(E)-but-2-Enyl]-N,N-diethyl-octa-2,6-dienamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.209264492 u
Formula C16H27NO
InChI InChI=1S/C16H27NO/c1-5-9-11-15(12-10-6-2)13-14-16(18)17(7-3)8-4/h5-6,9-10,13-15H,7-8,11-12H2,1-4H3/b9-5+,10-6+,14-13+
InChIKey PKZWYAPRDBSUCI-WONASCPISA-N
Molecular Weight 249.398 g/mol
SMILES C(\C=C\C(C\C=C\C)C\C=C\C)(N(CC)CC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.948516