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1-(3,3-Diphenylpropyl)-2-(trifluoromethyl)aziridine
SpectraBase Compound ID 5fE6fSnM3RH
InChI InChI=1S/C18H18F3N/c19-18(20,21)17-13-22(17)12-11-16(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16-17H,11-13H2
InChIKey UKMRWJNAQNEULK-UHFFFAOYSA-N
Mol Weight 305.34 g/mol
Molecular Formula C18H18F3N
Exact Mass 305.139134 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrSejLI0j1I
Name 1-(3,3-Diphenylpropyl)-2-(trifluoromethyl)aziridine
Appearance Yellow oil
Carrier Gas Helium
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Exact Mass 305.139134073 u
Formula C18H18F3N
InChI InChI=1S/C18H18F3N/c19-18(20,21)17-13-22(17)12-11-16(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16-17H,11-13H2
InChIKey UKMRWJNAQNEULK-UHFFFAOYSA-N
Instrument Name Agilent 5973
Ionization Type EI
Literature Reference DOI 10.1002/anie.201802347
Molecular Weight 305.344 g/mol
Quality 159
Reported Formula C18H19F3N
SMILES C1(=CC=CC=C1)C(CCN1C(C1)C(F)(F)F)C1=CC=CC=C1
SPLASH splash10-016r-1900000000-3773205069cd2b2044cd
Source of Spectrum ACI-57-SM34-3ad (DOI: 10.1002/anie.201802347)
Thin-Layer Chromatography 0.44 (hexanes/EtOAc, 10:1)
Wiley ID 1891027