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N-Butyl-2,5-dimethoxy-4-iodophenethylamine

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

N-Butyl-2,5-dimethoxy-4-iodophenethylamine
SpectraBase Compound ID BAm8dLhdg9c
InChI InChI=1S/C14H22INO2/c1-4-5-7-16-8-6-11-9-14(18-3)12(15)10-13(11)17-2/h9-10,16H,4-8H2,1-3H3
InChIKey WDEAMIXTHHZOJD-UHFFFAOYSA-N
Mol Weight 363.24 g/mol
Molecular Formula C14H22INO2
Exact Mass 363.069524 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GWmtcmYcK9x
Name N-Butyl-2,5-dimethoxy-4-iodophenethylamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.069523950 u
Formula C14H22INO2
InChI InChI=1S/C14H22INO2/c1-4-5-7-16-8-6-11-9-14(18-3)12(15)10-13(11)17-2/h9-10,16H,4-8H2,1-3H3
InChIKey WDEAMIXTHHZOJD-UHFFFAOYSA-N
Molecular Weight 363.239 g/mol
SMILES C=1(C(=CC(=C(C1)OC)I)OC)CCNCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.873657