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DOTFE N,N-bis(3-fluorobenzyl)
SpectraBase Compound ID IkkTp3PyU7d
InChI InChI=1S/C27H28F5NO2/c1-18(10-21-13-26(35-3)22(14-25(21)34-2)15-27(30,31)32)33(16-19-6-4-8-23(28)11-19)17-20-7-5-9-24(29)12-20/h4-9,11-14,18H,10,15-17H2,1-3H3
InChIKey QXCKWKVAMIKQDF-UHFFFAOYSA-N
Mol Weight 493.52 g/mol
Molecular Formula C27H28F5NO2
Exact Mass 493.20402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GViInRoDDc
Name DOTFE N,N-bis(3-fluorobenzyl)
Classification Amphetamine designer drug, stimulant, hallucinogenic
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 493.204019959 u
Formula C27H28F5NO2
InChI InChI=1S/C27H28F5NO2/c1-18(10-21-13-26(35-3)22(14-25(21)34-2)15-27(30,31)32)33(16-19-6-4-8-23(28)11-19)17-20-7-5-9-24(29)12-20/h4-9,11-14,18H,10,15-17H2,1-3H3
InChIKey QXCKWKVAMIKQDF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 493.518 g/mol
Nominal Mass 493 u
Quality 999
Retention Index 3665
SMILES C1(=C(C=C(C(=C1)OC)CC(F)(F)F)OC)CC(N(CC=1C=C(C=CC1)F)CC=1C=C(C=CC1)F)C
SPLASH splash10-08fr-0690000000-b4097c9730024350261a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-fluorobenzyl)-2,5-dimethoxy-4-(2,2,2-trifluoroethyl)amphetamine 1-(2,5-dimethoxy-4-(2,2,2-trifluoroethyl)phenyl)-N,N-bis(3-fluorobenzyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_020040