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(4aS,8R,8aS)-8-Cyclohexyl-6-oxoperhydro-1,4-ethano-1,5-naphthyridine
SpectraBase Compound ID DjgTHlhN7nC
InChI InChI=1S/C16H26N2O/c19-14-10-13(11-4-2-1-3-5-11)16-15(17-14)12-6-8-18(16)9-7-12/h11-13,15-16H,1-10H2,(H,17,19)/t13-,15+,16+/m1/s1
InChIKey XBCCNOZUNMYJMM-KBMXLJTQSA-N
Mol Weight 262.4 g/mol
Molecular Formula C16H26N2O
Exact Mass 262.204513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UvhHpJxtW8
Name (4aS,8R,8aS)-8-Cyclohexyl-6-oxoperhydro-1,4-ethano-1,5-naphthyridine
Comments Less than 3 mono-isotopic peaks
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Formula C16H26N2O
InChI InChI=1S/C16H26N2O/c19-14-10-13(11-4-2-1-3-5-11)16-15(17-14)12-6-8-18(16)9-7-12/h11-13,15-16H,1-10H2,(H,17,19)/t13-,15+,16+/m1/s1
InChIKey XBCCNOZUNMYJMM-KBMXLJTQSA-N
Molecular Weight 262.397 g/mol
SMILES N1C(C[C@@]([C@]2([C@@]1(C1CCN2CC1)[H])[H])(C1CCCCC1)[H])=O
SPLASH splash10-001i-9030000000-4c157681654443e4f458
Source of Spectrum KC-0-470-4
Synonyms (2S,3R,7S)-3-cyclohexyl-1,6-diazatricyclo[6.2.2.0(2,7)]dodecan-5-one (4aR*,8S*,8aR*)-8-Cyclohexyl-6-oxoperhydro-1,4-ethano-1,5-naphthyridine
Wiley ID 783085