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(2S,6S)-1-Benzyl-6-hydroxy-1,2,3,4-tetrahydro-2,6-methanobenzazocin-5-one
SpectraBase Compound ID 5SspKaA1fDh
InChI InChI=1S/C19H19NO2/c21-18-11-10-15-12-19(18,22)16-8-4-5-9-17(16)20(15)13-14-6-2-1-3-7-14/h1-9,15,22H,10-13H2/t15-,19-/m0/s1
InChIKey PYWSWCRBKZDTPO-KXBFYZLASA-N
Mol Weight 293.37 g/mol
Molecular Formula C19H19NO2
Exact Mass 293.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQaykYFFFOi
Name (2S,6S)-1-Benzyl-6-hydroxy-1,2,3,4-tetrahydro-2,6-methanobenzazocin-5-one
Appearance Yellowish solid
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Exact Mass 293.141578854 u
Formula C19H19NO2
InChI InChI=1S/C19H19NO2/c21-18-11-10-15-12-19(18,22)16-8-4-5-9-17(16)20(15)13-14-6-2-1-3-7-14/h1-9,15,22H,10-13H2/t15-,19-/m0/s1
InChIKey PYWSWCRBKZDTPO-KXBFYZLASA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405852
Quality 101
Reported Formula C19H19NO2
SMILES O[C@]12C=3C=CC=CC3N([C@@](C1)([H])CCC2=O)CC1=CC=CC=C1
SPLASH splash10-0006-9380000000-6dc2a7cfe9192d479d73
Source of Spectrum QE-21-SM23-28 (DOI: 10.1002/chem.201405852)
Thin-Layer Chromatography 0.29 (cyclohexane/Et2O, 1:1)
Wiley ID 1907599