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[2-(5-Chloranylthiophen-2-yl)quinolin-4-yl]-(2-methylpiperidin-1-yl)methanone
SpectraBase Compound ID 5PRaF8hYRl
InChI InChI=1S/C20H19ClN2OS/c1-13-6-4-5-11-23(13)20(24)15-12-17(18-9-10-19(21)25-18)22-16-8-3-2-7-14(15)16/h2-3,7-10,12-13H,4-6,11H2,1H3
InChIKey VTQSZOQEIPZKBR-UHFFFAOYSA-N
Mol Weight 370.9 g/mol
Molecular Formula C20H19ClN2OS
Exact Mass 370.090662 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 29mW87xPKKg
Name [2-(5-Chloranylthiophen-2-yl)quinolin-4-yl]-(2-methylpiperidin-1-yl)methanone
Comments Computed using HOSE algorithm
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Exact Mass 370.090662113 u
Formula C20H19ClN2OS
InChI InChI=1S/C20H19ClN2OS/c1-13-6-4-5-11-23(13)20(24)15-12-17(18-9-10-19(21)25-18)22-16-8-3-2-7-14(15)16/h2-3,7-10,12-13H,4-6,11H2,1H3
InChIKey VTQSZOQEIPZKBR-UHFFFAOYSA-N
Molecular Weight 370.898 g/mol
SMILES C1=C(C2=C(N=C1C1=CC=C(S1)Cl)C=CC=C2)C(N1C(CCCC1)C)=O