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2C-YN N,N-bis(3-trifluoromethylbenzyl)
SpectraBase Compound ID 7u82zaUNHQC
InChI InChI=1S/C28H25F6NO2/c1-4-21-15-26(37-3)22(16-25(21)36-2)11-12-35(17-19-7-5-9-23(13-19)27(29,30)31)18-20-8-6-10-24(14-20)28(32,33)34/h1,5-10,13-16H,11-12,17-18H2,2-3H3
InChIKey NHVKZPZRASHXET-UHFFFAOYSA-N
Mol Weight 521.5 g/mol
Molecular Formula C28H25F6NO2
Exact Mass 521.178948 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Ido5s7tYcC
Name 2C-YN N,N-bis(3-trifluoromethylbenzyl)
Classification Phenethylamine designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 521.178948025 u
Formula C28H25F6NO2
InChI InChI=1S/C28H25F6NO2/c1-4-21-15-26(37-3)22(16-25(21)36-2)11-12-35(17-19-7-5-9-23(13-19)27(29,30)31)18-20-8-6-10-24(14-20)28(32,33)34/h1,5-10,13-16H,11-12,17-18H2,2-3H3
InChIKey NHVKZPZRASHXET-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 521.503 g/mol
Nominal Mass 521 u
Quality 985
Retention Index 2786
SMILES C=1(C(=CC(=C(C1)OC)C#C)OC)CCN(CC=1C=C(C(F)(F)F)C=CC1)CC=1C=C(C(F)(F)F)C=CC1
SPLASH splash10-052b-0907000000-6a359584419fb088df87
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-trifluoromethylbenzyl)-2,5-dimethoxy-4-ethinylphenethylamine 2-(4-ethynyl-2,5-dimethoxyphenyl)-N,N-bis(3-(trifluoromethyl)benzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_020950