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cis-N-(Cyclohexylmethyl)-3-methoxy-N-methyl-3H-spiro[[2]benzofuran-1,1'-cyclohexan]-4'-amine
SpectraBase Compound ID DUvqKJCzMSP
InChI InChI=1S/C22H33NO2/c1-23(16-17-8-4-3-5-9-17)18-12-14-22(15-13-18)20-11-7-6-10-19(20)21(24-2)25-22/h6-7,10-11,17-18,21H,3-5,8-9,12-16H2,1-2H3/t18-,21?,22+
InChIKey UPNXBNHFBWGINS-WNIJEZSTSA-N
Mol Weight 343.5 g/mol
Molecular Formula C22H33NO2
Exact Mass 343.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ej3RqtCoP7
Name cis-N-(Cyclohexylmethyl)-3-methoxy-N-methyl-3H-spiro[[2]benzofuran-1,1'-cyclohexan]-4'-amine
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H33NO2
InChI InChI=1S/C22H33NO2/c1-23(16-17-8-4-3-5-9-17)18-12-14-22(15-13-18)20-11-7-6-10-19(20)21(24-2)25-22/h6-7,10-11,17-18,21H,3-5,8-9,12-16H2,1-2H3/t18-,21?,22+
InChIKey UPNXBNHFBWGINS-WNIJEZSTSA-N
Instrument Name Thermo-Finnigan MAT GCQ
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.9b00449
Molecular Weight 343.511 g/mol
SMILES c1ccc2[C@]3(CC[C@](N(CC4CCCCC4)C)(CC3)[H])OC(c2c1)OC
SPLASH splash10-03xr-0490000000-920fe89a9e1113354378
Source of Spectrum AF-62-SM17-15b
Thin-Layer Chromatography Rf = 0.12 (Cyclohexane/1% N, N-dimethylethanamine)
Wiley ID 1873895