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2C-TBU N,N-bis(3-trifluoromethylbenzyl)
SpectraBase Compound ID 4eF0SqxAfDJ
InChI InChI=1S/C30H33F6NO2/c1-28(2,3)25-17-26(38-4)22(16-27(25)39-5)12-13-37(18-20-8-6-10-23(14-20)29(31,32)33)19-21-9-7-11-24(15-21)30(34,35)36/h6-11,14-17H,12-13,18-19H2,1-5H3
InChIKey FFTFKRPORLNOJH-UHFFFAOYSA-N
Mol Weight 553.6 g/mol
Molecular Formula C30H33F6NO2
Exact Mass 553.241548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Ye062jVjHM
Name 2C-TBU N,N-bis(3-trifluoromethylbenzyl)
Classification Phenethylamine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 553.241548283 u
Formula C30H33F6NO2
InChI InChI=1S/C30H33F6NO2/c1-28(2,3)25-17-26(38-4)22(16-27(25)39-5)12-13-37(18-20-8-6-10-23(14-20)29(31,32)33)19-21-9-7-11-24(15-21)30(34,35)36/h6-11,14-17H,12-13,18-19H2,1-5H3
InChIKey FFTFKRPORLNOJH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 553.589 g/mol
Nominal Mass 553 u
Quality 971
Retention Index 2747
SMILES C(C1=C(C=C(C(=C1)OC)CCN(CC=1C=C(C(F)(F)F)C=CC1)CC=1C=C(C(F)(F)F)C=CC1)OC)(C)(C)C
SPLASH splash10-052b-0809000000-6275e4cddb809332c102
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-trifluoromethylbenzyl)-4-tert-butyl-2,5-dimethoxyphenethylamine 2-(4-tert-butyl-2,5-dimethoxyphenyl)-N,N-bis(3-(trifluoromethyl)benzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_020948