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(2S,6S)-6-Hydroxy-1,8,9-trimethyl-1,2,3,4-tetrahydro-2,6-methanobenzazocin-5-one
SpectraBase Compound ID Hjf2Bk2GDRI
InChI InChI=1S/C15H19NO2/c1-9-6-12-13(7-10(9)2)16(3)11-4-5-14(17)15(12,18)8-11/h6-7,11,18H,4-5,8H2,1-3H3/t11-,15-/m0/s1
InChIKey CUYWGKYENKZHOB-NHYWBVRUSA-N
Mol Weight 245.32 g/mol
Molecular Formula C15H19NO2
Exact Mass 245.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LdoSaPeEPjg
Name (2S,6S)-6-Hydroxy-1,8,9-trimethyl-1,2,3,4-tetrahydro-2,6-methanobenzazocin-5-one
Appearance Colorless oil
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Exact Mass 245.141578854 u
Formula C15H19NO2
InChI InChI=1S/C15H19NO2/c1-9-6-12-13(7-10(9)2)16(3)11-4-5-14(17)15(12,18)8-11/h6-7,11,18H,4-5,8H2,1-3H3/t11-,15-/m0/s1
InChIKey CUYWGKYENKZHOB-NHYWBVRUSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405852
Molecular Weight 245.322 g/mol
Quality 10
Reported Formula C15H19NO2
SMILES O[C@]12C=3C=C(C(=CC3N([C@](C1)(CCC2=O)[H])C)C)C
SPLASH splash10-000i-0940000000-cb6502b123fa53deeef9
Source of Spectrum QE-21-SM25-34 (DOI: 10.1002/chem.201405852)
Thin-Layer Chromatography 0.44 (cyclohexane/Et2O, 1:1)
Wiley ID 1907606