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p-Fluorobenzaldehyde 4-[3-pyridyl]-3-thiosemicarbazone

View entire compound with spectra: 1 NMR, and 1 FTIR

p-Fluorobenzaldehyde 4-[3-pyridyl]-3-thiosemicarbazone
SpectraBase Compound ID EH91pjIKUIP
InChI InChI=1S/C13H11FN4S/c14-11-5-3-10(4-6-11)8-16-18-13(19)17-12-2-1-7-15-9-12/h1-9H,(H2,17,18,19)/b16-8+
InChIKey HQOQIUZLQCWHRZ-LZYBPNLTSA-N
Mol Weight 274.32 g/mol
Molecular Formula C13H11FN4S
Exact Mass 274.068846 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GQ5NwTdXwA2
Name p-Fluorobenzaldehyde 4-[3-pyridyl]-3-thiosemicarbazone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.068845707 u
Formula C13H11FN4S
InChI InChI=1S/C13H11FN4S/c14-11-5-3-10(4-6-11)8-16-18-13(19)17-12-2-1-7-15-9-12/h1-9H,(H2,17,18,19)/b16-8+
InChIKey HQOQIUZLQCWHRZ-LZYBPNLTSA-N
Molecular Weight 274.317 g/mol
SMILES C1=C(C=CC(=C1)F)\C=N\NC(NC1=CC=CN=C1)=S
Spectrum/Structure Validation Score (Vapor Phase IR) 0.8358