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

*Links on SpectraBase are not permalinks.
2C-5-TOET N,N-bis(4-bromobenzyl)
SpectraBase Compound ID LFZDCuJaacP
InChI InChI=1S/C26H29Br2NOS/c1-4-21-15-25(30-2)22(16-26(21)31-3)13-14-29(17-19-5-9-23(27)10-6-19)18-20-7-11-24(28)12-8-20/h5-12,15-16H,4,13-14,17-18H2,1-3H3
InChIKey AFQJCRWGIQKSBQ-UHFFFAOYSA-N
Mol Weight 563.39 g/mol
Molecular Formula C26H29Br2NOS
Exact Mass 561.033662 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 JEZ3zv6sirg
Name 2C-5-TOET N,N-bis(4-bromobenzyl)
Classification Phenethylamine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 561.033661731 u
Formula C26H29Br2NOS
InChI InChI=1S/C26H29Br2NOS/c1-4-21-15-25(30-2)22(16-26(21)31-3)13-14-29(17-19-5-9-23(27)10-6-19)18-20-7-11-24(28)12-8-20/h5-12,15-16H,4,13-14,17-18H2,1-3H3
InChIKey AFQJCRWGIQKSBQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 563.392 g/mol
Nominal Mass 561 u
Quality 952
Retention Index 3822
SMILES C=1(C(=CC(=C(C1)SC)CC)OC)CCN(CC=1C=CC(=CC1)Br)CC=1C=CC(=CC1)Br
SPLASH splash10-01b9-1905000000-2e56c096971c18ab9e73
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(4-bromobenzyl)-2-[4-ethyl-2-methoxy-5-methylthiophenyl]-ethan-1-amine
Technique GC/MS
Wiley ID DD2024_021296