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3C-DFE N-(3-trifluoromethylbenzyl)
SpectraBase Compound ID Hn92MPRu1vJ
InChI InChI=1S/C21H24F5NO3/c1-13(27-11-14-5-4-6-16(8-14)21(24,25)26)7-15-9-17(28-2)20(18(10-15)29-3)30-12-19(22)23/h4-6,8-10,13,19,27H,7,11-12H2,1-3H3
InChIKey NEQNSCVJGJYLDD-UHFFFAOYSA-N
Mol Weight 433.42 g/mol
Molecular Formula C21H24F5NO3
Exact Mass 433.167634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmuccoX7SYy
Name 3C-DFE N-(3-trifluoromethylbenzyl)
Classification Amphetamine designer drug, stimulant, hallucinogenic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 433.167634449 u
Formula C21H24F5NO3
InChI InChI=1S/C21H24F5NO3/c1-13(27-11-14-5-4-6-16(8-14)21(24,25)26)7-15-9-17(28-2)20(18(10-15)29-3)30-12-19(22)23/h4-6,8-10,13,19,27H,7,11-12H2,1-3H3
InChIKey NEQNSCVJGJYLDD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 433.419 g/mol
Nominal Mass 433 u
Quality 941
Retention Index 2301
SMILES C=1(C(=CC(=CC1OC)CC(NCC=1C=C(C(F)(F)F)C=CC1)C)OC)OCC(F)F
SPLASH splash10-0udi-1690000000-1a9123bd2cd07cc36372
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Trifluoromethylbenzyl)-4-(2,2-difluoroethoxy)-3,5-dimethoxyamphetamine 1-(4-(2,2-difluoroethoxy)-3,5-dimethoxyphenyl)-N-(3-(trifluoromethyl)benzyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_020958