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4-(3,3,3-Trifluoro-1-phenylprop-1-en-2-yl)-1,1'-biphenyl
SpectraBase Compound ID IDPjf6sZx8P
InChI InChI=1S/C21H15F3/c22-21(23,24)20(15-16-7-3-1-4-8-16)19-13-11-18(12-14-19)17-9-5-2-6-10-17/h1-15H
InChIKey FAEZHCPGXFKQTL-UHFFFAOYSA-N
Mol Weight 324.35 g/mol
Molecular Formula C21H15F3
Exact Mass 324.112585 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ItqNN0D4SSt
Name 4-(3,3,3-Trifluoro-1-phenylprop-1-en-2-yl)-1,1'-biphenyl
Appearance White solid
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Formula C21H15F3
GC Column HP-5 MS (30 m x 250 micrometer, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C21H15F3/c22-21(23,24)20(15-16-7-3-1-4-8-16)19-13-11-18(12-14-19)17-9-5-2-6-10-17/h1-15H
InChIKey FAEZHCPGXFKQTL-UHFFFAOYSA-N
Instrument Name Agilent 7890B GC-5977B MSD
Ionization Type EI positive ion
Literature Reference DOI 10.1002/adsc.202300491
Molecular Weight 324.346 g/mol
Quality 631
Reported Formula C21H15F3
SMILES C(=CC1=CC=CC=C1)(C1=CC=C(C=C1)C1=CC=CC=C1)C(F)(F)F
SPLASH splash10-0fkc-1395000000-7d764f3a2cd29e87d769
Sample Comments E/Z = 1.3:1
Source of Spectrum ASC-365-SM20-2f (DOI: 10.1002/adsc.202300491)
Wiley ID 1909680