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3C-DFE N-(3-bromobenzyl)
SpectraBase Compound ID BNBfgkzlfKo
InChI InChI=1S/C20H24BrF2NO3/c1-13(24-11-14-5-4-6-16(21)8-14)7-15-9-17(25-2)20(18(10-15)26-3)27-12-19(22)23/h4-6,8-10,13,19,24H,7,11-12H2,1-3H3
InChIKey VOJAHJXXBRNKAG-UHFFFAOYSA-N
Mol Weight 444.32 g/mol
Molecular Formula C20H24BrF2NO3
Exact Mass 443.090763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkWOUFSeWci
Name 3C-DFE N-(3-bromobenzyl)
Classification Amphetamine designer drug, stimulant, hallucinogenic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 443.090762960 u
Formula C20H24BrF2NO3
InChI InChI=1S/C20H24BrF2NO3/c1-13(24-11-14-5-4-6-16(21)8-14)7-15-9-17(25-2)20(18(10-15)26-3)27-12-19(22)23/h4-6,8-10,13,19,24H,7,11-12H2,1-3H3
InChIKey VOJAHJXXBRNKAG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 444.317 g/mol
Nominal Mass 443 u
Quality 955
Retention Index 2632
SMILES C1(=C(C=C(C=C1OC)CC(NCC=1C=C(C=CC1)Br)C)OC)OCC(F)F
SPLASH splash10-03di-2490000000-22c777ade74fce496345
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Bromobenzyl)-4-(2,2-difluoroethoxy)-3,5-dimethoxyamphetamine N-(3-bromobenzyl)-1-(4-(2,2-difluoroethoxy)-3,5-dimethoxyphenyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_021201