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

*Links on SpectraBase are not permalinks.
2C-TBU N-(4-chlorobenzyl)
SpectraBase Compound ID HVgWnD2LiXS
InChI InChI=1S/C21H28ClNO2/c1-21(2,3)18-13-19(24-4)16(12-20(18)25-5)10-11-23-14-15-6-8-17(22)9-7-15/h6-9,12-13,23H,10-11,14H2,1-5H3
InChIKey OMQNJWLCGYNMLJ-UHFFFAOYSA-N
Mol Weight 361.91 g/mol
Molecular Formula C21H28ClNO2
Exact Mass 361.180857 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 8HGZUVcA7iC
Name 2C-TBU N-(4-chlorobenzyl)
Classification Phenethylamine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 361.180856844 u
Formula C21H28ClNO2
InChI InChI=1S/C21H28ClNO2/c1-21(2,3)18-13-19(24-4)16(12-20(18)25-5)10-11-23-14-15-6-8-17(22)9-7-15/h6-9,12-13,23H,10-11,14H2,1-5H3
InChIKey OMQNJWLCGYNMLJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 361.913 g/mol
Nominal Mass 361 u
Quality 986
Retention Index 2580
SMILES C(C1=C(C=C(C(=C1)OC)CCNCC=1C=CC(=CC1)Cl)OC)(C)(C)C
SPLASH splash10-0a6r-1950000000-0f9ec93976285b6c10f1
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(4-Chlorobenzyl)-4-tert-butyl-2,5-dimethoxyphenethylamine 2-(4-tert-butyl-2,5-dimethoxyphenyl)-N-(4-chlorobenzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_020679