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IMPURITY-1;1-[[[(1-R)-1-[3-[(1-E)-2-(7-CHLORO-2-QUINOLINYL)-ETHENYL]-PHENYL-3-[2-(1-HYDROXY-1-METHYLETHYL)-PHENYL]-PROPYL]-THI

View entire compound with spectra: 1 NMR

IMPURITY-1;1-[[[(1-R)-1-[3-[(1-E)-2-(7-CHLORO-2-QUINOLINYL)-ETHENYL]-PHENYL-3-[2-(1-HYDROXY-1-METHYLETHYL)-PHENYL]-PROPYL]-THI
SpectraBase Compound ID FMEGnzOdb9R
InChI InChI=1S/C35H37ClN2O2S/c1-34(2,40)30-9-4-3-7-25(30)13-17-32(41-23-35(18-19-35)22-33(37)39)27-8-5-6-24(20-27)10-15-29-16-12-26-11-14-28(36)21-31(26)38-29/h3-12,14-16,20-21,32,40H,13,17-19,22-23H2,1-2H3,(H2,37,39)/b15-10+/t32-/m0/s1
InChIKey MCYITTCDIONXIV-OYLFJNDKSA-N
Mol Weight 585.2 g/mol
Molecular Formula C35H37ClN2O2S
Exact Mass 584.226427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GFD77Bz7zso
Name IMPURITY-1;1-[[[(1-R)-1-[3-[(1-E)-2-(7-CHLORO-2-QUINOLINYL)-ETHENYL]-PHENYL-3-[2-(1-HYDROXY-1-METHYLETHYL)-PHENYL]-PROPYL]-THI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H37ClN2O2S
InChI InChI=1S/C35H37ClN2O2S/c1-34(2,40)30-9-4-3-7-25(30)13-17-32(41-23-35(18-19-35)22-33(37)39)27-8-5-6-24(20-27)10-15-29-16-12-26-11-14-28(36)21-31(26)38-29/h3-12,14-16,20-21,32,40H,13,17-19,22-23H2,1-2H3,(H2,37,39)/b15-10+/t32-/m0/s1
InChIKey MCYITTCDIONXIV-OYLFJNDKSA-N
Literature Reference Author M.SARAVANAN,K.S.KUMARI,P.P.REDDY,M.N.NAIDU,J.M.BABU,A.K.SRIV ASTAVA,T.L.KUMAR,B.V
Literature Reference Citation J.PHARM.BIOM.ANAL.,48,708(2008)
Literature Reference DOI 10.1016/j.jpba.2008.07.007
Molecular Weight 585.204 g/mol
Solvent CDCl3
Source File Reference UWMZ44292