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N,N-Bis(4-bromobenzyl)-2-fluoro-3,4-methylenedioxyamphetamine
SpectraBase Compound ID 1rk9UwODkJo
InChI InChI=1S/C24H22Br2FNO2/c1-16(12-19-6-11-22-24(23(19)27)30-15-29-22)28(13-17-2-7-20(25)8-3-17)14-18-4-9-21(26)10-5-18/h2-11,16H,12-15H2,1H3
InChIKey KWCRUSODQGCOPN-UHFFFAOYSA-N
Mol Weight 535.25 g/mol
Molecular Formula C24H22Br2FNO2
Exact Mass 533.000133 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lno7F76SEC
Name N,N-Bis(4-bromobenzyl)-2-fluoro-3,4-methylenedioxyamphetamine
Classification Methylenedioxyamphetamine designer drug, stimulant, entactogenic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 533.000133113 u
Formula C24H22Br2FNO2
InChI InChI=1S/C24H22Br2FNO2/c1-16(12-19-6-11-22-24(23(19)27)30-15-29-22)28(13-17-2-7-20(25)8-3-17)14-18-4-9-21(26)10-5-18/h2-11,16H,12-15H2,1H3
InChIKey KWCRUSODQGCOPN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 535.251 g/mol
Nominal Mass 533 u
Quality 1000
Retention Index 3697
SMILES C12=C(C(CC(N(CC=3C=CC(=CC3)Br)CC3=CC=C(C=C3)Br)C)=CC=C2OCO1)F
SPLASH splash10-00si-2905000000-7119bad784a11d377cd3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(4-bromobenzyl)-1-(4-fluoro-1,3-benzodioxol-5-yl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_019820