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1-(3-Iodobenzyl)-4-(2-fluorophenyl)piperazine
SpectraBase Compound ID 4qfpEDe8vKi
InChI InChI=1S/C17H18FIN2/c18-16-6-1-2-7-17(16)21-10-8-20(9-11-21)13-14-4-3-5-15(19)12-14/h1-7,12H,8-11,13H2
InChIKey JXECMNQPCSAVJW-UHFFFAOYSA-N
Mol Weight 396.25 g/mol
Molecular Formula C17H18FIN2
Exact Mass 396.049872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYp9rhe19Ki
Name 1-(3-Iodobenzyl)-4-(2-fluorophenyl)piperazine
Classification Piperazine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 396.049871751 u
Formula C17H18FIN2
InChI InChI=1S/C17H18FIN2/c18-16-6-1-2-7-17(16)21-10-8-20(9-11-21)13-14-4-3-5-15(19)12-14/h1-7,12H,8-11,13H2
InChIKey JXECMNQPCSAVJW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 396.248 g/mol
Nominal Mass 396 u
Quality 968
Retention Index 2555
SMILES C1(N2CCN(CC=3C=C(C=CC3)I)CC2)=C(C=CC=C1)F
SPLASH splash10-00di-5951000000-42e81cf2ac1ac4bd3c8e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Piperazine,1-(3-iodobenzyl)-4-(2-fluorophenyl) 1-(2-fluorophenyl)-4-(3-iodobenzyl)piperazine
Technique GC/MS
Wiley ID DD2024_011262