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3'-Bromo-4'-nitrononananilide

View entire compound with spectra: 1 FTIR, 1 Raman, and 1 UV-Vis

3'-Bromo-4'-nitrononananilide
SpectraBase Compound ID 7NG0ZjFyCT5
InChI InChI=1S/C15H21BrN2O3/c1-2-3-4-5-6-7-8-15(19)17-12-9-10-14(18(20)21)13(16)11-12/h9-11H,2-8H2,1H3,(H,17,19)
InChIKey NFCVWPPEZXZTOI-UHFFFAOYSA-N
Mol Weight 357.25 g/mol
Molecular Formula C15H21BrN2O3
Exact Mass 356.073556 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID JBqnCD2kGfh
Name 3'-Bromo-4'-nitrononananilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.073555541 u
Formula C15H21BrN2O3
InChI InChI=1S/C15H21BrN2O3/c1-2-3-4-5-6-7-8-15(19)17-12-9-10-14(18(20)21)13(16)11-12/h9-11H,2-8H2,1H3,(H,17,19)
InChIKey NFCVWPPEZXZTOI-UHFFFAOYSA-N
Molecular Weight 357.248 g/mol
SMILES N(=O)(=O)C=1C=CC(=CC1Br)NC(CCCCCCCC)=O
Spectrum/Structure Validation Score (Raman) 0.752851