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N-(Benzylidene)-2-methyl-4-pentenylamine

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

N-(Benzylidene)-2-methyl-4-pentenylamine
SpectraBase Compound ID Jubc4iuLANS
InChI InChI=1S/C13H17N/c1-3-7-12(2)10-14-11-13-8-5-4-6-9-13/h3-6,8-9,11-12H,1,7,10H2,2H3/b14-11+
InChIKey UOTMOFHINNODRQ-SDNWHVSQSA-N
Mol Weight 187.29 g/mol
Molecular Formula C13H17N
Exact Mass 187.1361 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J53UlpEpv1D
Name N-(Benzylidene)-2-methyl-4-pentenylamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 187.136099551 u
Formula C13H17N
InChI InChI=1S/C13H17N/c1-3-7-12(2)10-14-11-13-8-5-4-6-9-13/h3-6,8-9,11-12H,1,7,10H2,2H3/b14-11+
InChIKey UOTMOFHINNODRQ-SDNWHVSQSA-N
Molecular Weight 187.286 g/mol
SMILES C=1(\C=N\CC(CC=C)C)C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.90161