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5-TOET N-(3-iodobenzyl)
SpectraBase Compound ID 6OH0jqZEXvg
InChI InChI=1S/C20H26INOS/c1-5-16-11-19(23-3)17(12-20(16)24-4)9-14(2)22-13-15-7-6-8-18(21)10-15/h6-8,10-12,14,22H,5,9,13H2,1-4H3
InChIKey GNRHFSIMRJOLMR-UHFFFAOYSA-N
Mol Weight 455.4 g/mol
Molecular Formula C20H26INOS
Exact Mass 455.077981 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IoMoaZh8CW
Name 5-TOET N-(3-iodobenzyl)
Classification Amphetamine designer drug, stimulant, hallucinogenic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 455.077980634 u
Formula C20H26INOS
InChI InChI=1S/C20H26INOS/c1-5-16-11-19(23-3)17(12-20(16)24-4)9-14(2)22-13-15-7-6-8-18(21)10-15/h6-8,10-12,14,22H,5,9,13H2,1-4H3
InChIKey GNRHFSIMRJOLMR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 455.398 g/mol
Nominal Mass 455 u
Quality 911
Retention Index 2858
SMILES C=1(C(=CC(=C(C1)SC)CC)OC)CC(NCC=1C=C(C=CC1)I)C
SPLASH splash10-03di-4790000000-ed1ed24d17b754f96a78
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Iodobenzyl)-4-ethyl-2-methoxy-5-methylthioamphetamine 1-[4-Ethyl-2-methoxy-5-methylthiophenyl]-N-(3-iodobenzyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_020781