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(2S,6S)-6-Hydroxy-1-methyl-1,2,3,4-tetrahydro-2,6-methanobenzazocin-5-one
SpectraBase Compound ID 99XSaTzd86k
InChI InChI=1S/C13H15NO2/c1-14-9-6-7-12(15)13(16,8-9)10-4-2-3-5-11(10)14/h2-5,9,16H,6-8H2,1H3/t9-,13-/m0/s1
InChIKey ZUIZHOBMCHYKJR-ZANVPECISA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HuLIeMfoqzu
Name (2S,6S)-6-Hydroxy-1-methyl-1,2,3,4-tetrahydro-2,6-methanobenzazocin-5-one
Appearance Yellowish solid
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Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-14-9-6-7-12(15)13(16,8-9)10-4-2-3-5-11(10)14/h2-5,9,16H,6-8H2,1H3/t9-,13-/m0/s1
InChIKey ZUIZHOBMCHYKJR-ZANVPECISA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405852
Molecular Weight 217.268 g/mol
Quality 27
Reported Formula C13H15NO2
SMILES O[C@]12C=3C=CC=CC3N([C@@](C1)([H])CCC2=O)C
SPLASH splash10-03di-0920000000-20138eddea878bb652f0
Source of Spectrum QE-21-SM23-27 (DOI: 10.1002/chem.201405852)
Thin-Layer Chromatography 0.22 (cyclohexane/Et2O, 1:1)
Wiley ID 1907598