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3',4',6,7-Tetrachloro-3-phenylcarbostyril

View entire compound with spectra: 1 FTIR

3',4',6,7-Tetrachloro-3-phenylcarbostyril
SpectraBase Compound ID 4v0AQY4cFSn
InChI InChI=1S/C15H7Cl4NO/c16-10-2-1-7(4-11(10)17)9-3-8-5-12(18)13(19)6-14(8)20-15(9)21/h1-6H,(H,20,21)
InChIKey QRIQGQANNXFCQV-UHFFFAOYSA-N
Mol Weight 359.0 g/mol
Molecular Formula C15H7Cl4NO
Exact Mass 356.928175 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID WWZJSuApfi
Name 3',4',6,7-Tetrachloro-3-phenylcarbostyril
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.928174648 u
Formula C15H7Cl4NO
InChI InChI=1S/C15H7Cl4NO/c16-10-2-1-7(4-11(10)17)9-3-8-5-12(18)13(19)6-14(8)20-15(9)21/h1-6H,(H,20,21)
InChIKey QRIQGQANNXFCQV-UHFFFAOYSA-N
Molecular Weight 359.039 g/mol
SMILES C12=C(C=C(C(N2)=O)C2=CC=C(C(=C2)Cl)Cl)C=C(C(=C1)Cl)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.925142