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N-(2-Bromo-5-nitrobenzyl)phthalimide

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

N-(2-Bromo-5-nitrobenzyl)phthalimide
SpectraBase Compound ID G9G7nMobpmh
InChI InChI=1S/C15H9BrN2O4/c16-13-6-5-10(18(21)22)7-9(13)8-17-14(19)11-3-1-2-4-12(11)15(17)20/h1-7H,8H2
InChIKey ZAGMSJACWVTWFB-UHFFFAOYSA-N
Mol Weight 361.15 g/mol
Molecular Formula C15H9BrN2O4
Exact Mass 359.97457 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID L4L2UIf68Ys
Name N-(2-Bromo-5-nitrobenzyl)phthalimide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.974569774 u
Formula C15H9BrN2O4
InChI InChI=1S/C15H9BrN2O4/c16-13-6-5-10(18(21)22)7-9(13)8-17-14(19)11-3-1-2-4-12(11)15(17)20/h1-7H,8H2
InChIKey ZAGMSJACWVTWFB-UHFFFAOYSA-N
Molecular Weight 361.151 g/mol
SMILES C1(=O)C=2C(C(=O)N1CC=1C(=CC=C(C1)N(=O)=O)Br)=CC=CC2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.804761