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4-Bromo-benzoic acid N'-(2-chloro-acetyl)-hydrazide

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

4-Bromo-benzoic acid N'-(2-chloro-acetyl)-hydrazide
SpectraBase Compound ID 3JId2DhXO
InChI InChI=1S/C9H8BrClN2O2/c10-7-3-1-6(2-4-7)9(15)13-12-8(14)5-11/h1-4H,5H2,(H,12,14)(H,13,15)
InChIKey ANJMNKUMSGITKU-UHFFFAOYSA-N
Mol Weight 291.53 g/mol
Molecular Formula C9H8BrClN2O2
Exact Mass 289.945768 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CNSZ07D9XLv
Name 4-Bromo-benzoic acid N'-(2-chloro-acetyl)-hydrazide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.945768204 u
Formula C9H8BrClN2O2
InChI InChI=1S/C9H8BrClN2O2/c10-7-3-1-6(2-4-7)9(15)13-12-8(14)5-11/h1-4H,5H2,(H,12,14)(H,13,15)
InChIKey ANJMNKUMSGITKU-UHFFFAOYSA-N
Molecular Weight 291.532 g/mol
SMILES C1(C(NNC(CCl)=O)=O)=CC=C(C=C1)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.882913