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1-(4,7-DIMETHOXYBENZO-[B]-THIOPHEN-2-YL)-3-[4-(2-METHOXYPHENYL)-PIPERAZIN-1-YL]-1-PROPANOL
SpectraBase Compound ID 3ljr4l1Bw9t
InChI InChI=1S/C24H30N2O4S/c1-28-20-8-9-22(30-3)24-17(20)16-23(31-24)19(27)10-11-25-12-14-26(15-13-25)18-6-4-5-7-21(18)29-2/h4-9,16,19,27H,10-15H2,1-3H3
InChIKey FOJBAYACZXWLHU-UHFFFAOYSA-N
Mol Weight 442.57 g/mol
Molecular Formula C24H30N2O4S
Exact Mass 442.192629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BqVSa4HC01J
Name 1-(4,7-DIMETHOXYBENZO-[B]-THIOPHEN-2-YL)-3-[4-(2-METHOXYPHENYL)-PIPERAZIN-1-YL]-1-PROPANOL
Compound Number 8D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H30N2O4S
InChI InChI=1S/C24H30N2O4S/c1-28-20-8-9-22(30-3)24-17(20)16-23(31-24)19(27)10-11-25-12-14-26(15-13-25)18-6-4-5-7-21(18)29-2/h4-9,16,19,27H,10-15H2,1-3H3
InChIKey FOJBAYACZXWLHU-UHFFFAOYSA-N
Literature Reference Author H.PESSOA-MAHANA,G.RECABARREN-GAJARDO,J.F.TEMER,G.ZAPATA-TORR ES,C.D.PESSOA-MAHANA
Literature Reference Citation MOLECULES,17,1388(2012)
Literature Reference DOI 10.3390/molecules17021388
Molecular Weight 442.573 g/mol
Sample ID 73117
Solvent CDCl3