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2C-T-3 N,N-bis(3-trifluoromethylbenzyl)
SpectraBase Compound ID I82AS5VG2ZP
InChI InChI=1S/C30H31F6NO2S/c1-20(2)19-40-28-16-26(38-3)23(15-27(28)39-4)11-12-37(17-21-7-5-9-24(13-21)29(31,32)33)18-22-8-6-10-25(14-22)30(34,35)36/h5-10,13-16H,1,11-12,17-19H2,2-4H3
InChIKey KDWWIGSDDMKIOD-UHFFFAOYSA-N
Mol Weight 583.63 g/mol
Molecular Formula C30H31F6NO2S
Exact Mass 583.197969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIReWjokhcG
Name 2C-T-3 N,N-bis(3-trifluoromethylbenzyl)
Classification Phenethylamine designer drug
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 583.197969392 u
Formula C30H31F6NO2S
InChI InChI=1S/C30H31F6NO2S/c1-20(2)19-40-28-16-26(38-3)23(15-27(28)39-4)11-12-37(17-21-7-5-9-24(13-21)29(31,32)33)18-22-8-6-10-25(14-22)30(34,35)36/h5-10,13-16H,1,11-12,17-19H2,2-4H3
InChIKey KDWWIGSDDMKIOD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 583.633 g/mol
Nominal Mass 583 u
Quality 984
Retention Index 3080
SMILES C=1(C(=CC(=C(C1)OC)SCC(=C)C)OC)CCN(CC=1C=C(C(F)(F)F)C=CC1)CC=1C=C(C(F)(F)F)C=CC1
SPLASH splash10-0002-0509000000-0e05dba99e104ec5aee3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-trifluoromethylbenzyl)-2,5-dimethoxy-4-(beta-methallylthio)phenethylamine 2-(2,5-dimethoxy-4-((2-methylprop-2-en-1-yl)sulfanyl)phenyl)-N,N-bis(3-(trifluoromethyl)benzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_020804