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N,N-Bis(4-chlorobenzyl)-1-(3,4-difluoromethylenedioxyphenyl)butan-2-amine
SpectraBase Compound ID 4Pxt25pNZA5
InChI InChI=1S/C25H23Cl2F2NO2/c1-2-22(13-19-7-12-23-24(14-19)32-25(28,29)31-23)30(15-17-3-8-20(26)9-4-17)16-18-5-10-21(27)11-6-18/h3-12,14,22H,2,13,15-16H2,1H3
InChIKey PPAXAFACOFKIDT-UHFFFAOYSA-N
Mol Weight 478.37 g/mol
Molecular Formula C25H23Cl2F2NO2
Exact Mass 477.107391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oq2VrVuLYW
Name N,N-Bis(4-chlorobenzyl)-1-(3,4-difluoromethylenedioxyphenyl)butan-2-amine
Classification Phenylbutanamine designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 477.107390709 u
Formula C25H23Cl2F2NO2
InChI InChI=1S/C25H23Cl2F2NO2/c1-2-22(13-19-7-12-23-24(14-19)32-25(28,29)31-23)30(15-17-3-8-20(26)9-4-17)16-18-5-10-21(27)11-6-18/h3-12,14,22H,2,13,15-16H2,1H3
InChIKey PPAXAFACOFKIDT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 478.367 g/mol
Nominal Mass 477 u
Quality 999
Retention Index 3522
SMILES C1(OC=2C(O1)=CC(CC(N(CC=1C=CC(=CC1)Cl)CC1=CC=C(C=C1)Cl)CC)=CC2)(F)F
SPLASH splash10-056r-1905000000-bd84fac8cdfc28c151a0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(4-chlorobenzyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)butan-2-amine
Technique GC/MS
Wiley ID DD2024_019883