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1-Butanamine, N-(3-phenyl-2-propenylidene)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

1-Butanamine, N-(3-phenyl-2-propenylidene)-
SpectraBase Compound ID JUyAJ5GF60x
InChI InChI=1S/C13H17N/c1-2-3-11-14-12-7-10-13-8-5-4-6-9-13/h4-10,12H,2-3,11H2,1H3/b10-7+,14-12+
InChIKey XQAXOKLIOHMDIN-ZZZNDOSKSA-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 89fhtI5BaBk
Name 1-Butanamine, N-(3-phenyl-2-propenylidene)-
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/c1-2-3-11-14-12-7-10-13-8-5-4-6-9-13/h4-10,12H,2-3,11H2,1H3/b10-7+,14-12+
InChIKey XQAXOKLIOHMDIN-ZZZNDOSKSA-N
Molecular Weight 187.286 g/mol
SMILES C1=CC(\C=C\C=N\CCCC)=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.864669