For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-TOET N-(4-chlorobenzyl)
SpectraBase Compound ID ADfyhF2G5HU
InChI InChI=1S/C20H26ClNOS/c1-5-16-11-19(23-3)17(12-20(16)24-4)10-14(2)22-13-15-6-8-18(21)9-7-15/h6-9,11-12,14,22H,5,10,13H2,1-4H3
InChIKey IBMJDUHVPCPALX-UHFFFAOYSA-N
Mol Weight 363.95 g/mol
Molecular Formula C20H26ClNOS
Exact Mass 363.142363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JJ01PntY1Sq
Name 5-TOET N-(4-chlorobenzyl)
Classification Amphetamine designer drug, stimulant, hallucinogenic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 363.142363334 u
Formula C20H26ClNOS
InChI InChI=1S/C20H26ClNOS/c1-5-16-11-19(23-3)17(12-20(16)24-4)10-14(2)22-13-15-6-8-18(21)9-7-15/h6-9,11-12,14,22H,5,10,13H2,1-4H3
InChIKey IBMJDUHVPCPALX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 363.947 g/mol
Nominal Mass 363 u
Quality 989
Retention Index 2632
SMILES C=1(C(=CC(=C(C1)SC)CC)OC)CC(NCC=1C=CC(=CC1)Cl)C
SPLASH splash10-016r-0900000000-6ba5f02c1ff8a315ac9c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(4-Chlorobenzyl)-4-ethyl-2-methoxy-5-methylthioamphetamine N-(4-chlorobenzyl)-1-(4-ethyl-2-methoxy-5-methylthiophenyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_020655