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syn-Phenyl 3-(1,3-dimethyl-4-oxo-1,2,3,4-tetrahydroquinolin-2-yl)propanoate
SpectraBase Compound ID GwVMWjGnQTK
InChI InChI=1S/C20H21NO3/c1-14-17(12-13-19(22)24-15-8-4-3-5-9-15)21(2)18-11-7-6-10-16(18)20(14)23/h3-11,14,17H,12-13H2,1-2H3/t14-,17+/m0/s1
InChIKey IAYGEJKBJGKYPZ-WMLDXEAASA-N
Mol Weight 323.39 g/mol
Molecular Formula C20H21NO3
Exact Mass 323.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8r2lSHZvXvV
Name syn-Phenyl 3-(1,3-dimethyl-4-oxo-1,2,3,4-tetrahydroquinolin-2-yl)propanoate
Appearance Yellow oil
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Exact Mass 323.152143537 u
Formula C20H21NO3
InChI InChI=1S/C20H21NO3/c1-14-17(12-13-19(22)24-15-8-4-3-5-9-15)21(2)18-11-7-6-10-16(18)20(14)23/h3-11,14,17H,12-13H2,1-2H3/t14-,17+/m0/s1
InChIKey IAYGEJKBJGKYPZ-WMLDXEAASA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405852
Molecular Weight 323.392 g/mol
Quality 91
Reported Formula C20H21NO3
SMILES C[C@]1([C@](N(C2=C(C1=O)C=CC=C2)C)(CCC(OC1=CC=CC=C1)=O)[H])[H]
SPLASH splash10-00di-0913000000-b14292859763bc741164
Source of Spectrum QE-21-SM18-15 (DOI: 10.1002/chem.201405852)
Thin-Layer Chromatography 0.61 (CH2Cl2/EtOAc, 10:1)
Wiley ID 1907586