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[4-[2-(4-bromo-phenyl)-2-oxo-ethyl]-piperazin-1-yl]-acetonitrile
SpectraBase Compound ID 4Te9KhFnzZH
InChI InChI=1S/C14H16BrN3O/c15-13-3-1-12(2-4-13)14(19)11-18-9-7-17(6-5-16)8-10-18/h1-4H,6-11H2
InChIKey LJFLJZRVPBOBFV-UHFFFAOYSA-N
Mol Weight 322.21 g/mol
Molecular Formula C14H16BrN3O
Exact Mass 321.047675 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9Nf8P8xtNH
Name [4-[2-(4-bromo-phenyl)-2-oxo-ethyl]-piperazin-1-yl]-acetonitrile
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Formula C14H16BrN3O
InChI InChI=1S/C14H16BrN3O/c15-13-3-1-12(2-4-13)14(19)11-18-9-7-17(6-5-16)8-10-18/h1-4H,6-11H2
InChIKey LJFLJZRVPBOBFV-UHFFFAOYSA-N
Molecular Weight 322.206 g/mol
SMILES c1cc(C(CN2CCN(CC2)CC#N)=O)ccc1Br
SPLASH splash10-000i-5900000000-3436ba84dbed4277942f
Synonyms (4-[2-(4-Bromophenyl)-2-oxoethyl]-1-piperazinyl)acetonitrile 2-[4-[2-(4-bromophenyl)-2-keto-ethyl]piperazino]acetonitrile 2-[4-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanenitrile 2-[4-[2-(4-bromophenyl)-2-oxo-ethyl]piperazin-1-yl]acetonitrile 2-[4-[2-(4-bromophenyl)-2-oxoethyl]-1-piperazinyl]acetonitrile
Wiley ID 1461971