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cis-2-(Bicyclo[4.1.0]heptan-7-yl)-N-ethyl-1-phenylethan-1-amine
SpectraBase Compound ID 6Kg6twNEDbs
InChI InChI=1S/C17H25N/c1-2-18-17(13-8-4-3-5-9-13)12-16-14-10-6-7-11-15(14)16/h3-5,8-9,14-18H,2,6-7,10-12H2,1H3/t14-,15+,16-,17?
InChIKey CXROAFAUTYMEBI-JEVFAZOZSA-N
Mol Weight 243.39 g/mol
Molecular Formula C17H25N
Exact Mass 243.1987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Vo8A8gJYhx
Name cis-2-(Bicyclo[4.1.0]heptan-7-yl)-N-ethyl-1-phenylethan-1-amine
Appearance Brown oil
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Exact Mass 243.198699809 u
Formula C17H25N
InChI InChI=1S/C17H25N/c1-2-18-17(13-8-4-3-5-9-13)12-16-14-10-6-7-11-15(14)16/h3-5,8-9,14-18H,2,6-7,10-12H2,1H3/t14-,15+,16-,17?
InChIKey CXROAFAUTYMEBI-JEVFAZOZSA-N
Instrument Name Thermo Scientific DFS/Shimadzu GCMS-QP2020
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200991
Molecular Weight 243.394 g/mol
Quality 137
Reported Formula C17H25N
SMILES N(C(C[C@]1([C@]2([H])CCCC[C@]12[H])[H])C1=CC=CC=C1)CC
SPLASH splash10-001i-6900000000-eb2853171cf152795df1
Source of Spectrum K1-2022-SM32-32l (DOI: 10.1002/ejoc.202200991)
Thin-Layer Chromatography 0.15 (SiO2, PE/EtOAc/HNEt2, 100:5:1)
Wiley ID 1898961