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Benzaldehyde, 2-hydroxy-5-nitro-, thiosemicarbazone

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

Benzaldehyde, 2-hydroxy-5-nitro-, thiosemicarbazone
SpectraBase Compound ID 2dUPeoo28oR
InChI InChI=1S/C8H8N4O3S/c9-8(16)11-10-4-5-3-6(12(14)15)1-2-7(5)13/h1-4,13H,(H3,9,11,16)/b10-4+
InChIKey MJMFGGYKUSTJSO-ONNFQVAWSA-N
Mol Weight 240.24 g/mol
Molecular Formula C8H8N4O3S
Exact Mass 240.031711 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Io3bHqA2M4d
Name Benzaldehyde, 2-hydroxy-5-nitro-, thiosemicarbazone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.031711305 u
Formula C8H8N4O3S
InChI InChI=1S/C8H8N4O3S/c9-8(16)11-10-4-5-3-6(12(14)15)1-2-7(5)13/h1-4,13H,(H3,9,11,16)/b10-4+
InChIKey MJMFGGYKUSTJSO-ONNFQVAWSA-N
Molecular Weight 240.237 g/mol
SMILES C1(=CC(=CC=C1O)N(=O)=O)\C=N\NC(N)=S
Spectrum/Structure Validation Score (Vapor Phase IR) 0.87248