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2C-TBU N,N-bis(2-fluorobenzyl)
SpectraBase Compound ID jcpSTICiWg
InChI InChI=1S/C28H33F2NO2/c1-28(2,3)23-17-26(32-4)20(16-27(23)33-5)14-15-31(18-21-10-6-8-12-24(21)29)19-22-11-7-9-13-25(22)30/h6-13,16-17H,14-15,18-19H2,1-5H3
InChIKey PXWODEQOCCTXHK-UHFFFAOYSA-N
Mol Weight 453.6 g/mol
Molecular Formula C28H33F2NO2
Exact Mass 453.247936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFB9lnNWFXs
Name 2C-TBU N,N-bis(2-fluorobenzyl)
Classification Phenethylamine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 453.247935631 u
Formula C28H33F2NO2
InChI InChI=1S/C28H33F2NO2/c1-28(2,3)23-17-26(32-4)20(16-27(23)33-5)14-15-31(18-21-10-6-8-12-24(21)29)19-22-11-7-9-13-25(22)30/h6-13,16-17H,14-15,18-19H2,1-5H3
InChIKey PXWODEQOCCTXHK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 453.574 g/mol
Nominal Mass 453 u
Quality 993
Retention Index 2889
SMILES C1(=C(C=C(C(=C1)OC)CCN(CC=1C(=CC=CC1)F)CC=1C(=CC=CC1)F)OC)C(C)(C)C
SPLASH splash10-0002-0490000000-57a2e57fbfe231ce33c0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(2-fluorobenzyl)-4-tert-butyl-2,5-dimethoxyphenethylamine 2-(4-tert-butyl-2,5-dimethoxyphenyl)-N,N-bis(2-fluorobenzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_020757