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1-[(3S,4S)-8-methyl-3-(2-naphthalenyl)-8-azabicyclo[3.2.1]octan-4-yl]-1-propanone

View entire compound with spectra: 1 MS (GC)

1-[(3S,4S)-8-methyl-3-(2-naphthalenyl)-8-azabicyclo[3.2.1]octan-4-yl]-1-propanone
SpectraBase Compound ID Cj6yrKKocwV
InChI InChI=1S/C21H25NO/c1-3-20(23)21-18(13-17-10-11-19(21)22(17)2)16-9-8-14-6-4-5-7-15(14)12-16/h4-9,12,17-19,21H,3,10-11,13H2,1-2H3/t17-,18+,19+,21-/m0/s1
InChIKey WJVLEIDMFWNIAA-PXCRPINLSA-N
Mol Weight 307.44 g/mol
Molecular Formula C21H25NO
Exact Mass 307.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6F45GuGCJKj
Name 1-[(3S,4S)-8-methyl-3-(2-naphthalenyl)-8-azabicyclo[3.2.1]octan-4-yl]-1-propanone
Alternate Name(s) 1-[(3S,4S)-8-methyl-3-(2-naphthyl)-8-azabicyclo[3.2.1]octan-4-yl]propan-1-one 1-[(3S,4S)-8-methyl-3-naphthalen-2-yl-8-azabicyclo[3.2.1]octan-4-yl]propan-1-one
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Formula C21H25NO
InChI InChI=1S/C21H25NO/c1-3-20(23)21-18(13-17-10-11-19(21)22(17)2)16-9-8-14-6-4-5-7-15(14)12-16/h4-9,12,17-19,21H,3,10-11,13H2,1-2H3/t17-,18+,19+,21-/m0/s1
InChIKey WJVLEIDMFWNIAA-PXCRPINLSA-N
Molecular Weight 307.437 g/mol
SMILES [C@]12([C@]([C@](C[C@](CC2)(N1C)[H])(c1cc2c(cc1)cccc2)[H])(C(CC)=O)[H])[H]
SPLASH splash10-0zgi-5196000000-840f24493788fd0b191d
Source of Spectrum E1-37-1266-21
Wiley ID 1575098