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N,N-Bis(3-trifluoromethylbenzyl)-(4-fluoroaniline)
SpectraBase Compound ID GJCvLL1kEI2
InChI InChI=1S/C22H16F7N/c23-19-7-9-20(10-8-19)30(13-15-3-1-5-17(11-15)21(24,25)26)14-16-4-2-6-18(12-16)22(27,28)29/h1-12H,13-14H2
InChIKey BLGAKZPNRBCPTF-UHFFFAOYSA-N
Mol Weight 427.37 g/mol
Molecular Formula C22H16F7N
Exact Mass 427.117097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGNxImCWSWG
Name 4-Fluoro-N,N-bis([3-(trifluoromethyl)phenyl]methyl)aniline
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 427.117096660 u
Formula C22H16F7N
InChI InChI=1S/C22H16F7N/c23-19-7-9-20(10-8-19)30(13-15-3-1-5-17(11-15)21(24,25)26)14-16-4-2-6-18(12-16)22(27,28)29/h1-12H,13-14H2
InChIKey BLGAKZPNRBCPTF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 427.366 g/mol
Nominal Mass 427 u
Quality 979
Retention Index 2129
SMILES C=1(N(CC2=CC(C(F)(F)F)=CC=C2)CC=2C=C(C(F)(F)F)C=CC2)C=CC(=CC1)F
SPLASH splash10-0a6r-1940200000-380517d6c1b00aa3adab
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_028337