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3C-DFE N-(3-iodobenzyl)
SpectraBase Compound ID 1hGJtOzjjvL
InChI InChI=1S/C20H24F2INO3/c1-13(24-11-14-5-4-6-16(23)8-14)7-15-9-17(25-2)20(18(10-15)26-3)27-12-19(21)22/h4-6,8-10,13,19,24H,7,11-12H2,1-3H3
InChIKey YCQFWVQWUJBTGF-UHFFFAOYSA-N
Mol Weight 491.32 g/mol
Molecular Formula C20H24F2INO3
Exact Mass 491.076895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoC0QjxeEhE
Name 3C-DFE N-(3-iodobenzyl)
Classification Amphetamine designer drug, stimulant, hallucinogenic
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 491.076894960 u
Formula C20H24F2INO3
InChI InChI=1S/C20H24F2INO3/c1-13(24-11-14-5-4-6-16(23)8-14)7-15-9-17(25-2)20(18(10-15)26-3)27-12-19(21)22/h4-6,8-10,13,19,24H,7,11-12H2,1-3H3
InChIKey YCQFWVQWUJBTGF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 491.317 g/mol
Nominal Mass 491 u
Quality 993
Retention Index 2807
SMILES C1(=C(C=C(C=C1OC)CC(NCC=1C=C(C=CC1)I)C)OC)OCC(F)F
SPLASH splash10-03di-1190000000-10f8030861355226db2e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Iodobenzyl)-4-(2,2-difluoroethoxy)-3,5-dimethoxyamphetamine 1-[4-(2,2-Difluoroethoxy)-3,5-dimethoxyphenyl]-N-(3-iodobenzyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_020799