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8-Methyl-3-(4'-cyanophenoxy)-3-phenyl-8-azabicyclo[3.2.1]octane
SpectraBase Compound ID IFeF1paLsTs
InChI InChI=1S/C21H22N2O/c1-23-18-9-10-19(23)14-21(13-18,17-5-3-2-4-6-17)24-20-11-7-16(15-22)8-12-20/h2-8,11-12,18-19H,9-10,13-14H2,1H3/t18-,19+,21+
InChIKey MHDHVXPMXSVPAC-KXTWHKPSSA-N
Mol Weight 318.42 g/mol
Molecular Formula C21H22N2O
Exact Mass 318.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30ynidIKxwn
Name 8-Methyl-3-(4'-cyanophenoxy)-3-phenyl-8-azabicyclo[3.2.1]octane
Alternate Name(s) 4-((8-methyl-3-phenyl-8-azabicyclo[3.2.1]octan-3-yl)oxy)benzonitrile 4-[(8-methyl-3-phenyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]benzenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O
InChI InChI=1S/C21H22N2O/c1-23-18-9-10-19(23)14-21(13-18,17-5-3-2-4-6-17)24-20-11-7-16(15-22)8-12-20/h2-8,11-12,18-19H,9-10,13-14H2,1H3/t18-,19+,21+
InChIKey MHDHVXPMXSVPAC-KXTWHKPSSA-N
Molecular Weight 318.420 g/mol
SMILES [C@]1(C[C@@]2(CC[C@@](N2C)(C1)[H])[H])(Oc1ccc(C#N)cc1)c1ccccc1
SPLASH splash10-0udi-3190000000-606f680b95be0e866821
Source of Spectrum J-15-7770-14b
Wiley ID 1733886