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N,N-Bis-(3-Trifluoromethylbenzyl)-4-(2,2-difluoroethoxy)-2,6-dimethoxyamphetamine
SpectraBase Compound ID 3uWUEPPjLo8
InChI InChI=1S/C29H29F8NO3/c1-18(10-24-25(39-2)13-23(14-26(24)40-3)41-17-27(30)31)38(15-19-6-4-8-21(11-19)28(32,33)34)16-20-7-5-9-22(12-20)29(35,36)37/h4-9,11-14,18,27H,10,15-17H2,1-3H3
InChIKey GBWVYKMKUPDXRC-UHFFFAOYSA-N
Mol Weight 591.54 g/mol
Molecular Formula C29H29F8NO3
Exact Mass 591.201969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ly06g8u24
Name N,N-Bis-(3-Trifluoromethylbenzyl)-4-(2,2-difluoroethoxy)-2,6-dimethoxyamphetamine
Classification Amphetamine designer drug, stimulant, hallucinogenic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 591.201969099 u
Formula C29H29F8NO3
InChI InChI=1S/C29H29F8NO3/c1-18(10-24-25(39-2)13-23(14-26(24)40-3)41-17-27(30)31)38(15-19-6-4-8-21(11-19)28(32,33)34)16-20-7-5-9-22(12-20)29(35,36)37/h4-9,11-14,18,27H,10,15-17H2,1-3H3
InChIKey GBWVYKMKUPDXRC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 591.542 g/mol
Nominal Mass 591 u
Quality 982
Retention Index 4327
SMILES C=1(C(=CC(=CC1OC)OCC(F)F)OC)CC(N(CC=1C=C(C(F)(F)F)C=CC1)CC1=CC(C(F)(F)F)=CC=C1)C
SPLASH splash10-08fr-0709000000-9f8807f18e369df92479
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(4-(2,2-difluoroethoxy)-2,6-dimethoxyphenyl)-N,N-bis(3-(trifluoromethyl)benzyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_019670