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2-((1S,2S)-4,5-dimethyl-1,2,3,6-tetrahydro-[1,1'-biphenyl]-2-carbonyl)pyridine 1-oxide
SpectraBase Compound ID 80yZXxgS7oZ
InChI InChI=1S/C20H21NO2/c1-14-12-17(16-8-4-3-5-9-16)18(13-15(14)2)20(22)19-10-6-7-11-21(19)23/h3-11,17-18H,12-13H2,1-2H3/t17-,18+/m1/s1
InChIKey AIXNTUJLTXYSKS-MSOLQXFVSA-N
Mol Weight 307.39 g/mol
Molecular Formula C20H21NO2
Exact Mass 307.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ETJyGoMBmeJ
Name 2-((1S,2S)-4,5-dimethyl-1,2,3,6-tetrahydro-[1,1'-biphenyl]-2-carbonyl)pyridine 1-oxide
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Formula C20H21NO2
InChI InChI=1S/C20H21NO2/c1-14-12-17(16-8-4-3-5-9-16)18(13-15(14)2)20(22)19-10-6-7-11-21(19)23/h3-11,17-18H,12-13H2,1-2H3/t17-,18+/m1/s1
InChIKey AIXNTUJLTXYSKS-MSOLQXFVSA-N
Literature Reference DOI 10.1021/ol0705752
Molecular Weight 307.393 g/mol
SMILES C(=O)(c1[n+](cccc1)[O-])[C@@]1([C@](CC(=C(C1)C)C)(c1ccccc1)[H])[H]
SPLASH splash10-002f-5590000000-d0e97d9258c08da71cdf
Source of Spectrum A1-9-1983/SMS9-9
Wiley ID 1758131