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2C-TBU N-(3-bromobenzyl)
SpectraBase Compound ID BiOaG3LyDA0
InChI InChI=1S/C21H28BrNO2/c1-21(2,3)18-13-19(24-4)16(12-20(18)25-5)9-10-23-14-15-7-6-8-17(22)11-15/h6-8,11-13,23H,9-10,14H2,1-5H3
InChIKey FPZWRNOSRTZVSP-UHFFFAOYSA-N
Mol Weight 406.36 g/mol
Molecular Formula C21H28BrNO2
Exact Mass 405.130342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8G8gWrZf0FM
Name 2C-TBU N-(3-bromobenzyl)
Classification Phenethylamine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 405.130342144 u
Formula C21H28BrNO2
InChI InChI=1S/C21H28BrNO2/c1-21(2,3)18-13-19(24-4)16(12-20(18)25-5)9-10-23-14-15-7-6-8-17(22)11-15/h6-8,11-13,23H,9-10,14H2,1-5H3
InChIKey FPZWRNOSRTZVSP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 406.364 g/mol
Nominal Mass 405 u
Quality 975
Retention Index 2633
SMILES C1(=C(C(C)(C)C)C=C(C(=C1)CCNCC=1C=C(C=CC1)Br)OC)OC
SPLASH splash10-0a4i-1890000000-617cdb852576ff169391
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Bromobenzyl)-4-tert-butyl-2,5-dimethoxyphenethylamine N-(3-bromobenzyl)-2-(4-tert-butyl-2,5-dimethoxyphenyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_021188