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Benzoic acid, [3-(3-bromophenyl)-3-hydroxyallylidene]hydrazide
SpectraBase Compound ID JFzHAEOkgHq
InChI InChI=1S/C16H13BrN2O2/c17-14-8-4-7-13(11-14)15(20)9-10-18-19-16(21)12-5-2-1-3-6-12/h1-11,20H,(H,19,21)/b15-9-,18-10+
InChIKey BNSLYSWZACJKES-PFVOVTSXSA-N
Mol Weight 345.2 g/mol
Molecular Formula C16H13BrN2O2
Exact Mass 344.016041 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID G8yOxrXVc4O
Name Benzoic acid, [3-(3-bromophenyl)-3-hydroxyallylidene]hydrazide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.016040665 u
Formula C16H13BrN2O2
InChI InChI=1S/C16H13BrN2O2/c17-14-8-4-7-13(11-14)15(20)9-10-18-19-16(21)12-5-2-1-3-6-12/h1-11,20H,(H,19,21)/b15-9-,18-10+
InChIKey BNSLYSWZACJKES-PFVOVTSXSA-N
Molecular Weight 345.196 g/mol
SMILES C(N\N=C\C=C\(C1=CC(Br)=CC=C1)O)(=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.877729