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N-Isopropyl-3-cyano-2,3-diisopropyl-4,4-dimethylbut-1-enylideneimine(ketenimine)
SpectraBase Compound ID DS8ocWFgqlO
InChI InChI=1S/C16H28N2/c1-11(2)15(9-18-14(7)8)16(10-17,12(3)4)13(5)6/h11-14H,1-8H3
InChIKey NYFCDARRRMYCGS-UHFFFAOYSA-N
Mol Weight 248.41 g/mol
Molecular Formula C16H28N2
Exact Mass 248.225249 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GaV7r19UQkl
Name N-Isopropyl-3-cyano-2,3-diisopropyl-4,4-dimethylbut-1-enylideneimine(ketenimine)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.225248910 u
Formula C16H28N2
InChI InChI=1S/C16H28N2/c1-11(2)15(9-18-14(7)8)16(10-17,12(3)4)13(5)6/h11-14H,1-8H3
InChIKey NYFCDARRRMYCGS-UHFFFAOYSA-N
Molecular Weight 248.414 g/mol
SMILES C(=C=NC(C)C)(C(C#N)(C(C)C)C(C)C)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929207