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Doip N,N-bis(3-bromobenzyl)

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

Doip N,N-bis(3-bromobenzyl)
SpectraBase Compound ID 9lo7qtSuGtT
InChI InChI=1S/C28H33Br2NO2/c1-19(2)26-16-27(32-4)23(15-28(26)33-5)12-20(3)31(17-21-8-6-10-24(29)13-21)18-22-9-7-11-25(30)14-22/h6-11,13-16,19-20H,12,17-18H2,1-5H3
InChIKey QMCDBKOSWUPPAR-UHFFFAOYSA-N
Mol Weight 575.4 g/mol
Molecular Formula C28H33Br2NO2
Exact Mass 573.087805 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4xdEU4RaE6y
Name Doip N,N-bis(3-bromobenzyl)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 573.087805305 u
Formula C28H33Br2NO2
InChI InChI=1S/C28H33Br2NO2/c1-19(2)26-16-27(32-4)23(15-28(26)33-5)12-20(3)31(17-21-8-6-10-24(29)13-21)18-22-9-7-11-25(30)14-22/h6-11,13-16,19-20H,12,17-18H2,1-5H3
InChIKey QMCDBKOSWUPPAR-UHFFFAOYSA-N
Molecular Weight 575.385 g/mol
SMILES C=1(C(=CC(=C(C1)OC)C(C)C)OC)CC(N(CC=1C=C(C=CC1)Br)CC=1C=C(C=CC1)Br)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.816845