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tert-butyl (2S)-6-ethyl-3-methyl-2-phenyl-2H-pyridine-1-carboxylate
SpectraBase Compound ID FqrkSycEaOs
InChI InChI=1S/C19H25NO2/c1-6-16-13-12-14(2)17(15-10-8-7-9-11-15)20(16)18(21)22-19(3,4)5/h7-13,17H,6H2,1-5H3/t17-/m0/s1
InChIKey YNCDOVFTAQLCEL-KRWDZBQOSA-N
Mol Weight 299.41 g/mol
Molecular Formula C19H25NO2
Exact Mass 299.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCFW0ZtmpIX
Name tert-butyl (2S)-6-ethyl-3-methyl-2-phenyl-2H-pyridine-1-carboxylate
Appearance Colorless oil
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Formula C19H25NO2
InChI InChI=1S/C19H25NO2/c1-6-16-13-12-14(2)17(15-10-8-7-9-11-15)20(16)18(21)22-19(3,4)5/h7-13,17H,6H2,1-5H3/t17-/m0/s1
InChIKey YNCDOVFTAQLCEL-KRWDZBQOSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 299.414 g/mol
Optical Rotation [a]D20 = -395.2 (c = 1.15, CHCl3)
Reported Formula C18H23NO2
SMILES C=1(N([C@@](C(=CC1)C)(c1ccccc1)[H])C(=O)OC(C)(C)C)CC
SPLASH splash10-0603-3950000000-66bbe60dd5d54fb60e30
Sample Comments >99% ee
Source of Spectrum CN110590644A
Wiley ID 1874942