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DOTFE N,N-bis(3-trifluoromethylbenzyl)
SpectraBase Compound ID 1tyLVTxVZpG
InChI InChI=1S/C29H28F9NO2/c1-18(10-21-13-26(41-3)22(14-25(21)40-2)15-27(30,31)32)39(16-19-6-4-8-23(11-19)28(33,34)35)17-20-7-5-9-24(12-20)29(36,37)38/h4-9,11-14,18H,10,15-17H2,1-3H3
InChIKey QTFUCAKBGAJUAL-UHFFFAOYSA-N
Mol Weight 593.53 g/mol
Molecular Formula C29H28F9NO2
Exact Mass 593.197633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IUwadfx0bo
Name DOTFE N,N-bis(3-trifluoromethylbenzyl)
Classification Amphetamine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 593.197632611 u
Formula C29H28F9NO2
InChI InChI=1S/C29H28F9NO2/c1-18(10-21-13-26(41-3)22(14-25(21)40-2)15-27(30,31)32)39(16-19-6-4-8-23(11-19)28(33,34)35)17-20-7-5-9-24(12-20)29(36,37)38/h4-9,11-14,18H,10,15-17H2,1-3H3
InChIKey QTFUCAKBGAJUAL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 593.534 g/mol
Nominal Mass 593 u
Quality 999
Retention Index 2616
SMILES C1(=C(C=C(C(=C1)OC)CC(F)(F)F)OC)CC(N(CC=1C=C(C(F)(F)F)C=CC1)CC=1C=C(C(F)(F)F)C=CC1)C
SPLASH splash10-03di-0309000000-0aa51442051d287e5218
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(2,5-Dimethoxy-4-(2,2,2-trifluoroethyl)phenyl)-N,N-bis(3-trifluoromethylbenzyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_022072