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6-[4-(Trifluoromethyl)phenyl]-6H-dibenzo[b,h]carbazole
SpectraBase Compound ID 9ZWFlNUaHxX
InChI InChI=1S/C27H16F3N/c28-27(29,30)21-9-11-22(12-10-21)31-25-15-19-7-3-1-5-17(19)13-23(25)24-14-18-6-2-4-8-20(18)16-26(24)31/h1-16H
InChIKey RRBMYMWJLAUDLQ-UHFFFAOYSA-N
Mol Weight 411.43 g/mol
Molecular Formula C27H16F3N
Exact Mass 411.123484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fntUBrLMJe
Name 6-[4-(Trifluoromethyl)phenyl]-6H-dibenzo[b,h]carbazole
Appearance Yellow needle
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Exact Mass 411.123484008 u
Formula C27H16F3N
InChI InChI=1S/C27H16F3N/c28-27(29,30)21-9-11-22(12-10-21)31-25-15-19-7-3-1-5-17(19)13-23(25)24-14-18-6-2-4-8-20(18)16-26(24)31/h1-16H
InChIKey RRBMYMWJLAUDLQ-UHFFFAOYSA-N
Instrument Name JEOL JMP DX300
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900464
Molecular Weight 411.427 g/mol
Quality 24
Reported Formula C27H16F3N
SMILES C1=CC=CC2=CC=3N(C=4C=C5C(=CC4C3C=C12)C=CC=C5)C1=CC=C(C=C1)C(F)(F)F
SPLASH splash10-03di-0000900000-08bdf3a614406c132e6a
Source of Spectrum K1-2019-3792-5g (DOI: 10.1002/ejoc.201900464)
Thin-Layer Chromatography 0.3 (n-hexane/CH2Cl2, 5:1)
Wiley ID 1891866