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3C-DFE N-(4-chlorobenzyl)
SpectraBase Compound ID LSol42e6kQF
InChI InChI=1S/C20H24ClF2NO3/c1-13(24-11-14-4-6-16(21)7-5-14)8-15-9-17(25-2)20(18(10-15)26-3)27-12-19(22)23/h4-7,9-10,13,19,24H,8,11-12H2,1-3H3
InChIKey NKMOORLDTOWNIJ-UHFFFAOYSA-N
Mol Weight 399.87 g/mol
Molecular Formula C20H24ClF2NO3
Exact Mass 399.141278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XcmVkhAyZs
Name 3C-DFE N-(4-chlorobenzyl)
Classification Amphetamine designer drug, stimulant, hallucinogenic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 399.141277660 u
Formula C20H24ClF2NO3
InChI InChI=1S/C20H24ClF2NO3/c1-13(24-11-14-4-6-16(21)7-5-14)8-15-9-17(25-2)20(18(10-15)26-3)27-12-19(22)23/h4-7,9-10,13,19,24H,8,11-12H2,1-3H3
InChIKey NKMOORLDTOWNIJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 399.866 g/mol
Nominal Mass 399 u
Quality 972
Retention Index 2521
SMILES C1(=C(C=C(C=C1OC)CC(NCC=1C=CC(=CC1)Cl)C)OC)OCC(F)F
SPLASH splash10-016r-1900000000-4e88bb25b59587318cfb
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(4-Chlorobenzyl)-4-(2,2-difluoroethoxy)-3,5-dimethoxyamphetamine N-(4-chlorobenzyl)-1-(4-(2,2-difluoroethoxy)-3,5-dimethoxyphenyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_020694