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cis-N-(2-(Bicyclo[4.1.0]heptan-7-yl)-1-(4-(trifluoromethyl)phenyl)ethyl)aniline
SpectraBase Compound ID HcEB7vyMRsf
InChI InChI=1S/C22H24F3N/c23-22(24,25)16-12-10-15(11-13-16)21(26-17-6-2-1-3-7-17)14-20-18-8-4-5-9-19(18)20/h1-3,6-7,10-13,18-21,26H,4-5,8-9,14H2/t18-,19+,20-,21?
InChIKey QYPFLWWOBYHHFV-CWNQJQRUSA-N
Mol Weight 359.44 g/mol
Molecular Formula C22H24F3N
Exact Mass 359.186084 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3H7AKK3BUKW
Name cis-N-(2-(Bicyclo[4.1.0]heptan-7-yl)-1-(4-(trifluoromethyl)phenyl)ethyl)aniline
Appearance Light-brown resin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.186084266 u
Formula C22H24F3N
InChI InChI=1S/C22H24F3N/c23-22(24,25)16-12-10-15(11-13-16)21(26-17-6-2-1-3-7-17)14-20-18-8-4-5-9-19(18)20/h1-3,6-7,10-13,18-21,26H,4-5,8-9,14H2/t18-,19+,20-,21?
InChIKey QYPFLWWOBYHHFV-CWNQJQRUSA-N
Instrument Name Thermo Scientific DFS/Shimadzu GCMS-QP2020
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200991
Molecular Weight 359.436 g/mol
Quality 109
SMILES N(C1=CC=CC=C1)C(C=1C=CC(C(F)(F)F)=CC1)C[C@]1([C@]2([H])CCCC[C@]12[H])[H]
SPLASH splash10-0udi-6190000000-cae0983cc0774d94e4dd
Source of Spectrum K1-2022-SM30-30l (DOI: 10.1002/ejoc.202200991)
Thin-Layer Chromatography 0.36 (SiO2, PE/EtOAc/HNEt2, 100:5:1)
Wiley ID 1898960