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N,N-Bis(3-trifluoromethylbenzyl)beta-methylbenzeneethanamine
SpectraBase Compound ID 608TQ56Gcsb
InChI InChI=1S/C25H23F6N/c1-18(21-9-3-2-4-10-21)15-32(16-19-7-5-11-22(13-19)24(26,27)28)17-20-8-6-12-23(14-20)25(29,30)31/h2-14,18H,15-17H2,1H3
InChIKey OFKIMNUXZQNOKZ-UHFFFAOYSA-N
Mol Weight 451.46 g/mol
Molecular Formula C25H23F6N
Exact Mass 451.173469 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GW0iwbqgjIW
Name N,N-Bis(3-trifluoromethylbenzyl)beta-methylbenzeneethanamine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 451.173468723 u
Formula C25H23F6N
InChI InChI=1S/C25H23F6N/c1-18(21-9-3-2-4-10-21)15-32(16-19-7-5-11-22(13-19)24(26,27)28)17-20-8-6-12-23(14-20)25(29,30)31/h2-14,18H,15-17H2,1H3
InChIKey OFKIMNUXZQNOKZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 451.456 g/mol
Nominal Mass 451 u
Quality 1000
Retention Index 2307
SMILES C(C1=CC(CN(CC=2C=C(C(F)(F)F)C=CC2)CC(C=2C=CC=CC2)C)=CC=C1)(F)(F)F
SPLASH splash10-0a4j-1906000000-40d6c0af97eb5f998634
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-trifluoromethylbenzyl)beta-methylphenethylamine 2-phenyl-N,N-bis(3-(trifluoromethyl)benzyl)propan-1-amine
Technique GC/MS
Wiley ID DD2024_022004