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cis-N-(2-(Bicyclo[4.1.0]heptan-7-yl)-1-phenylethyl)-4-methylaniline
SpectraBase Compound ID 6YmAUUQE1ZN
InChI InChI=1S/C22H27N/c1-16-11-13-18(14-12-16)23-22(17-7-3-2-4-8-17)15-21-19-9-5-6-10-20(19)21/h2-4,7-8,11-14,19-23H,5-6,9-10,15H2,1H3/t19-,20+,21-,22?
InChIKey RPSGFXJNYJVNDN-PVTQMLBVSA-N
Mol Weight 305.46 g/mol
Molecular Formula C22H27N
Exact Mass 305.21435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 174jtpUvaH3
Name cis-N-(2-(Bicyclo[4.1.0]heptan-7-yl)-1-phenylethyl)-4-methylaniline
Appearance Yellow-brown resin
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Exact Mass 305.214349873 u
Formula C22H27N
InChI InChI=1S/C22H27N/c1-16-11-13-18(14-12-16)23-22(17-7-3-2-4-8-17)15-21-19-9-5-6-10-20(19)21/h2-4,7-8,11-14,19-23H,5-6,9-10,15H2,1H3/t19-,20+,21-,22?
InChIKey RPSGFXJNYJVNDN-PVTQMLBVSA-N
Instrument Name Thermo Scientific DFS/Shimadzu GCMS-QP2020
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200991
Quality 123
Reported Formula C22H27N
SMILES N(C=1C=CC(=CC1)C)C(C[C@]1([C@@]2([C@]1(CCCC2)[H])[H])[H])C1=CC=CC=C1
SPLASH splash10-0002-6900000000-c8915ad9525b42b54aa0
Source of Spectrum K1-2022-SM23-23l (DOI: 10.1002/ejoc.202200991)
Thin-Layer Chromatography 0.41 (SiO2, hexanes/EtOAc/Et2NH, 100:5:1)
Wiley ID 1898955