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1,4-bis(4-bromo-2,5-dimethoxybenzyl)piperazine
SpectraBase Compound ID IIrocLPQaQh
InChI InChI=1S/C22H28Br2N2O4/c1-27-19-11-17(23)21(29-3)9-15(19)13-25-5-7-26(8-6-25)14-16-10-22(30-4)18(24)12-20(16)28-2/h9-12H,5-8,13-14H2,1-4H3
InChIKey VCXYEAYHMFBSGP-UHFFFAOYSA-N
Mol Weight 544.28 g/mol
Molecular Formula C22H28Br2N2O4
Exact Mass 542.041583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5WEeiwoWQue
Name 1,4-Di(4-Bromo-2,5-dimethoxybenzyl)piperazine
Classification Piperazine derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 542.041583386 u
Formula C22H28Br2N2O4
InChI InChI=1S/C22H28Br2N2O4/c1-27-19-11-17(23)21(29-3)9-15(19)13-25-5-7-26(8-6-25)14-16-10-22(30-4)18(24)12-20(16)28-2/h9-12H,5-8,13-14H2,1-4H3
InChIKey VCXYEAYHMFBSGP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 544.284 g/mol
Nominal Mass 542 u
Quality 986
Retention Index 3768
SMILES C=1(C(=CC(=C(C1)OC)Br)OC)CN1CCN(CC=2C(=CC(=C(C2)OC)Br)OC)CC1
SPLASH splash10-02e9-2494000000-a6d3b9fb8d36e06cb87d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Piperazine,1,4-di(4-Bromo-2,5-dimethoxybenzyl) 1,4-bis(4-bromo-2,5-dimethoxybenzyl)piperazine
Technique GC/MS
Wiley ID DD2024_006518