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5TF-2C-H N,N-bis(3-trifluoromethylbenzyl)
SpectraBase Compound ID LpfcU9pjeDh
InChI InChI=1S/C26H22F9NO2/c1-37-23-9-8-22(38-26(33,34)35)14-19(23)10-11-36(15-17-4-2-6-20(12-17)24(27,28)29)16-18-5-3-7-21(13-18)25(30,31)32/h2-9,12-14H,10-11,15-16H2,1H3
InChIKey DPXCDOFWWDYRMY-UHFFFAOYSA-N
Mol Weight 551.45 g/mol
Molecular Formula C26H22F9NO2
Exact Mass 551.150682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JH7TROAToHY
Name 5TF-2C-H N,N-bis(3-trifluoromethylbenzyl)
Classification Phenethylamine designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 551.150682417 u
Formula C26H22F9NO2
InChI InChI=1S/C26H22F9NO2/c1-37-23-9-8-22(38-26(33,34)35)14-19(23)10-11-36(15-17-4-2-6-20(12-17)24(27,28)29)16-18-5-3-7-21(13-18)25(30,31)32/h2-9,12-14H,10-11,15-16H2,1H3
InChIKey DPXCDOFWWDYRMY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 551.453 g/mol
Nominal Mass 551 u
Quality 995
Retention Index 2394
SMILES C(C1=CC(CN(CC2=CC(C(F)(F)F)=CC=C2)CCC2=C(C=CC(=C2)OC(F)(F)F)OC)=CC=C1)(F)(F)F
SPLASH splash10-0002-0509000000-cc781a65ef24bca1fc82
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-trifluoromethylbenzyl)-2-methoxy-5-trifluoromethoxyphenethylamine 2-(2-methoxy-5-(trifluoromethoxy)phenyl)-N,N-bis(3-(trifluoromethyl)benzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_020926