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2-Methoxyphenethylamine N-(4-bromobenzyl)

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

2-Methoxyphenethylamine N-(4-bromobenzyl)
SpectraBase Compound ID 14Yf3uqEV7I
InChI InChI=1S/C16H18BrNO/c1-19-16-5-3-2-4-14(16)10-11-18-12-13-6-8-15(17)9-7-13/h2-9,18H,10-12H2,1H3
InChIKey QWIGSZMHHPPRII-UHFFFAOYSA-N
Mol Weight 320.23 g/mol
Molecular Formula C16H18BrNO
Exact Mass 319.057177 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EMCHT6wrbeR
Name 2-Methoxyphenethylamine N-(4-bromobenzyl)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.057177203 u
Formula C16H18BrNO
InChI InChI=1S/C16H18BrNO/c1-19-16-5-3-2-4-14(16)10-11-18-12-13-6-8-15(17)9-7-13/h2-9,18H,10-12H2,1H3
InChIKey QWIGSZMHHPPRII-UHFFFAOYSA-N
Molecular Weight 320.230 g/mol
SMILES C=1(C(=CC=CC1)OC)CCNCC=1C=CC(=CC1)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947127