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(4aS,8R,8aS)-8-Phenylperhydro-1,4-ethano-1,5-naphthyridine
SpectraBase Compound ID LZZf0AzKR8L
InChI InChI=1S/C16H22N2/c1-2-4-12(5-3-1)14-6-9-17-15-13-7-10-18(11-8-13)16(14)15/h1-5,13-17H,6-11H2/t14-,15+,16+/m1/s1
InChIKey UUPAUTCKEBUIQO-PMPSAXMXSA-N
Mol Weight 242.37 g/mol
Molecular Formula C16H22N2
Exact Mass 242.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6J4cL3C8h5f
Name (4aS,8R,8aS)-8-Phenylperhydro-1,4-ethano-1,5-naphthyridine
Alternate Name(s) (2S,3R,7S)-3-phenyl-1,6-diazatricyclo[6.2.2.0(2,7)]dodecane (4aR*,8S*,8aR*)-8-Phenylperhydro-1,4-ethano-1,5-naphthyridine
Comments Less than 3 mono-isotopic peaks
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Formula C16H22N2
InChI InChI=1S/C16H22N2/c1-2-4-12(5-3-1)14-6-9-17-15-13-7-10-18(11-8-13)16(14)15/h1-5,13-17H,6-11H2/t14-,15+,16+/m1/s1
InChIKey UUPAUTCKEBUIQO-PMPSAXMXSA-N
Molecular Weight 242.366 g/mol
SMILES N1CC[C@@]([C@]2([C@@]1(C1CCN2CC1)[H])[H])(c1ccccc1)[H]
SPLASH splash10-0005-9050000000-22c7e74b5ead32f52463
Source of Spectrum KC-0-470-5
Wiley ID 783084