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(E)-1-Amino-N-isopropyl-N-benzoylbuta-1,3-diene

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

(E)-1-Amino-N-isopropyl-N-benzoylbuta-1,3-diene
SpectraBase Compound ID F9OGpMGLSe6
InChI InChI=1S/C11H17NO/c1-5-7-9-12(10(3)4)11(13)8-6-2/h5-10H,1H2,2-4H3/b8-6+,9-7+
InChIKey NTWWENSOORDTLH-CDJQDVQCSA-N
Mol Weight 179.26 g/mol
Molecular Formula C11H17NO
Exact Mass 179.131014 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 59ZI9Nuyk5R
Name (E)-1-Amino-N-isopropyl-N-benzoylbuta-1,3-diene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 179.131014170 u
Formula C11H17NO
InChI InChI=1S/C11H17NO/c1-5-7-9-12(10(3)4)11(13)8-6-2/h5-10H,1H2,2-4H3/b8-6+,9-7+
InChIKey NTWWENSOORDTLH-CDJQDVQCSA-N
Molecular Weight 179.263 g/mol
SMILES C(N(\C=C\C=C)C(C)C)(\C=C\C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.923273