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DIPROPYL-2-[BENZOFURAN-2-YL-[(6-CHLOROBENZO-[D]-THIAZOL-2-YL)-AMINO]-METHYL]-MALONATE
SpectraBase Compound ID 4AIiWhuxuIp
InChI InChI=1S/C25H25ClN2O5S/c1-3-11-31-23(29)21(24(30)32-12-4-2)22(19-13-15-7-5-6-8-18(15)33-19)28-25-27-17-10-9-16(26)14-20(17)34-25/h5-10,13-14,21-22H,3-4,11-12H2,1-2H3,(H,27,28)/t22-/m1/s1
InChIKey YEHVKTZLSAIXBZ-JOCHJYFZSA-N
Mol Weight 501.0 g/mol
Molecular Formula C25H25ClN2O5S
Exact Mass 500.117271 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LYO5TGD0O3z
Name DIPROPYL-2-[BENZOFURAN-2-YL-[(6-CHLOROBENZO-[D]-THIAZOL-2-YL)-AMINO]-METHYL]-MALONATE
Compound Number 5G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H25ClN2O5S
InChI InChI=1S/C25H25ClN2O5S/c1-3-11-31-23(29)21(24(30)32-12-4-2)22(19-13-15-7-5-6-8-18(15)33-19)28-25-27-17-10-9-16(26)14-20(17)34-25/h5-10,13-14,21-22H,3-4,11-12H2,1-2H3,(H,27,28)/t22-/m1/s1
InChIKey YEHVKTZLSAIXBZ-JOCHJYFZSA-N
Literature Reference Author H.XIAO,P.ZHENG,C.TANG,Y.XIE,F.WU,J.SONG,J.ZHAO,Z.LI,M.LI
Literature Reference Citation MOLECULES,18,13623(2013)
Literature Reference DOI 10.3390/molecules181113623
Molecular Weight 500.997 g/mol
Solvent CDCl3
Source File Reference UWIR9863