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Ethyl 2-Chloro-3-[4-[[1-(4-methylquinolin-2-yl)-(2S)-pyrrolildin-2-yl]methoxy]phenyl]propanoate
SpectraBase Compound ID Mf0E3dYySe
InChI InChI=1S/C26H29ClN2O3/c1-3-31-26(30)23(27)16-19-10-12-21(13-11-19)32-17-20-7-6-14-29(20)25-15-18(2)22-8-4-5-9-24(22)28-25/h4-5,8-13,15,20,23H,3,6-7,14,16-17H2,1-2H3/t20-,23?/m0/s1
InChIKey JKEREJDQXVGKBC-AJZOCDQUSA-N
Mol Weight 452.98 g/mol
Molecular Formula C26H29ClN2O3
Exact Mass 452.18667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rUVOwgauoD
Name Ethyl 2-Chloro-3-[4-[[1-(4-methylquinolin-2-yl)-(2S)-pyrrolildin-2-yl]methoxy]phenyl]propanoate
Alternate Name(s) 2-Chloro-3-[4-[[(2S)-1-(4-methyl-2-quinolinyl)-2-pyrrolidinyl]methoxy]phenyl]propanoic acid ethyl ester Ethyl 2-chloro-3-[4-[[(2S)-1-(4-methylquinolin-2-yl)pyrrolidin-2-yl]methoxy]phenyl]propanoate Ethyl 2-chloro-3-[4-[[(2S)-1-(4-methyl-2-quinolyl)pyrrolidin-2-yl]methoxy]phenyl]propanoate Ethyl 2-chloranyl-3-[4-[[(2S)-1-(4-methylquinolin-2-yl)pyrrolidin-2-yl]methoxy]phenyl]propanoate
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Formula C26H29ClN2O3
InChI InChI=1S/C26H29ClN2O3/c1-3-31-26(30)23(27)16-19-10-12-21(13-11-19)32-17-20-7-6-14-29(20)25-15-18(2)22-8-4-5-9-24(22)28-25/h4-5,8-13,15,20,23H,3,6-7,14,16-17H2,1-2H3/t20-,23?/m0/s1
InChIKey JKEREJDQXVGKBC-AJZOCDQUSA-N
Molecular Weight 452.982 g/mol
SMILES c1(nc2ccccc2c(c1)C)N1[C@](COc2ccc(CC(C(=O)OCC)Cl)cc2)(CCC1)[H]
SPLASH splash10-03di-0190000000-47fcf8778fc06582a309
Source of Spectrum F2-42-2579-0
Wiley ID 1600210