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2-Chloro-5-fluoro-4-[4-(thiophene-2-carbonyl)-piperazin-1-yl]-benzonitrile
SpectraBase Compound ID 1d8bE3pVNAE
InChI InChI=1S/C16H13ClFN3OS/c17-12-9-14(13(18)8-11(12)10-19)20-3-5-21(6-4-20)16(22)15-2-1-7-23-15/h1-2,7-9H,3-6H2
InChIKey FYWHOGNIYYPQON-UHFFFAOYSA-N
Mol Weight 349.81 g/mol
Molecular Formula C16H13ClFN3OS
Exact Mass 349.045189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMEFKnkD5cH
Name 2-Chloro-5-fluoro-4-[4-(thiophene-2-carbonyl)-piperazin-1-yl]-benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClFN3OS
InChI InChI=1S/C16H13ClFN3OS/c17-12-9-14(13(18)8-11(12)10-19)20-3-5-21(6-4-20)16(22)15-2-1-7-23-15/h1-2,7-9H,3-6H2
InChIKey FYWHOGNIYYPQON-UHFFFAOYSA-N
Molecular Weight 349.811 g/mol
SMILES C(N1CCN(c2cc(Cl)c(cc2F)C#N)CC1)(c1sccc1)=O
SPLASH splash10-08fr-6921000000-b1caa6fe1556894af599
Synonyms 2-Chloranyl-5-fluoranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)benzenecarbonitrile 2-Chloro-5-fluoro-4-[4-(2-thenoyl)piperazino]benzonitrile 2-Chloro-5-fluoro-4-[4-(2-thienylcarbonyl)-1-piperazinyl]benzonitrile 2-Chloro-5-fluoro-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]benzonitrile
Wiley ID 1461842