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MAL N,N-bis(3-trifluoromethylbenzyl)
SpectraBase Compound ID EYNJY6kUrCJ
InChI InChI=1S/C30H31F6NO3/c1-20(2)19-40-28-26(38-3)15-21(16-27(28)39-4)11-12-37(17-22-7-5-9-24(13-22)29(31,32)33)18-23-8-6-10-25(14-23)30(34,35)36/h5-10,13-16H,1,11-12,17-19H2,2-4H3
InChIKey UIHPTNMIFWOYPF-UHFFFAOYSA-N
Mol Weight 567.57 g/mol
Molecular Formula C30H31F6NO3
Exact Mass 567.220813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YtTELBzmGu
Name MAL N,N-bis(3-trifluoromethylbenzyl)
Classification Phenethylamine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 567.220812837 u
Formula C30H31F6NO3
InChI InChI=1S/C30H31F6NO3/c1-20(2)19-40-28-26(38-3)15-21(16-27(28)39-4)11-12-37(17-22-7-5-9-24(13-22)29(31,32)33)18-23-8-6-10-25(14-23)30(34,35)36/h5-10,13-16H,1,11-12,17-19H2,2-4H3
InChIKey UIHPTNMIFWOYPF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 567.572 g/mol
Nominal Mass 567 u
Quality 960
Retention Index 2856
SMILES C1(=C(C=C(C=C1OC)CCN(CC=1C=C(C(F)(F)F)C=CC1)CC1=CC(C(F)(F)F)=CC=C1)OC)OCC(=C)C
SPLASH splash10-052b-1908000000-4ee71a59ee6b44cca581
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-trifluoromethylbenzyl)-3,5-dimethoxy-4-methalloxyphenethanamine N,N-Bis(3-trifluoromethylbenzyl)-2-(3,5-Dimethoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_020936