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1-(p-Methoxybenzyl)aminobuta-1,3-diene

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

1-(p-Methoxybenzyl)aminobuta-1,3-diene
SpectraBase Compound ID CUwYzKOhKj3
InChI InChI=1S/C12H15NO/c1-3-4-9-13-10-11-5-7-12(14-2)8-6-11/h3-9,13H,1,10H2,2H3/b9-4+
InChIKey NWYCEGQDMDTHES-RUDMXATFSA-N
Mol Weight 189.26 g/mol
Molecular Formula C12H15NO
Exact Mass 189.115364 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BlOcWjojVny
Name 1-(p-Methoxybenzyl)aminobuta-1,3-diene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 189.115364106 u
Formula C12H15NO
InChI InChI=1S/C12H15NO/c1-3-4-9-13-10-11-5-7-12(14-2)8-6-11/h3-9,13H,1,10H2,2H3/b9-4+
InChIKey NWYCEGQDMDTHES-RUDMXATFSA-N
Molecular Weight 189.258 g/mol
SMILES C(\C=C\NCC=1C=CC(=CC1)OC)=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.955409