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3-[4-(2-Fluoro-4-propionylphenyl)-1-piperazinyl]propanenitrile
SpectraBase Compound ID 49LRLgx4U4N
InChI InChI=1S/C16H20FN3O/c1-2-16(21)13-4-5-15(14(17)12-13)20-10-8-19(9-11-20)7-3-6-18/h4-5,12H,2-3,7-11H2,1H3
InChIKey MDNDBDPCQIYLKY-UHFFFAOYSA-N
Mol Weight 289.35 g/mol
Molecular Formula C16H20FN3O
Exact Mass 289.15904 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6XEOilTB3p
Name 3-[4-(2-Fluoro-4-propionylphenyl)-1-piperazinyl]propanenitrile
CAS Registry Number 351040-59-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20FN3O
InChI InChI=1S/C16H20FN3O/c1-2-16(21)13-4-5-15(14(17)12-13)20-10-8-19(9-11-20)7-3-6-18/h4-5,12H,2-3,7-11H2,1H3
InChIKey MDNDBDPCQIYLKY-UHFFFAOYSA-N
Molecular Weight 289.354 g/mol
SMILES CCC(c1ccc(N2CCN(CC2)CCC#N)c(c1)F)=O
SPLASH splash10-000e-6490000000-abb0332b3c19fa60a007
Source of Spectrum AD-0-2532-0
Synonyms 3-[4-(2-fluoranyl-4-propanoyl-phenyl)piperazin-1-yl]propanenitrile 3-[4-(2-fluoro-4-propanoyl-phenyl)piperazin-1-yl]propanenitrile 3-[4-(2-fluoro-4-propionyl-phenyl)piperazino]propionitrile 3-[4-[2-fluoro-4-(1-oxopropyl)phenyl]-1-piperazinyl]propanenitrile Propanenitrile, 3-[2-fluoro-4-(4-propanoyl)phenylpiperazin-1-yl]-
Wiley ID 1431204