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2-[5-[4-(2-METHOXYPHENYL)-1-PIPERAZIN-1-YL]-PENTANOYLAMINO]-4,5,6,7-TETRAHYDROBENZO-[B]-THIOPHENE-3-CARBOXYLIC-ACID-ETHYLESTER

View entire compound with spectra: 1 NMR

2-[5-[4-(2-METHOXYPHENYL)-1-PIPERAZIN-1-YL]-PENTANOYLAMINO]-4,5,6,7-TETRAHYDROBENZO-[B]-THIOPHENE-3-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID 8Y8jsro4E8d
InChI InChI=1S/C27H37N3O4S/c1-3-34-27(32)25-20-10-4-7-13-23(20)35-26(25)28-24(31)14-8-9-15-29-16-18-30(19-17-29)21-11-5-6-12-22(21)33-2/h5-6,11-12H,3-4,7-10,13-19H2,1-2H3,(H,28,31)
InChIKey ZPRQBRYSRONYBK-UHFFFAOYSA-N
Mol Weight 499.7 g/mol
Molecular Formula C27H37N3O4S
Exact Mass 499.250478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DJ7OamKLZ4Z
Name 2-[5-[4-(2-METHOXYPHENYL)-1-PIPERAZIN-1-YL]-PENTANOYLAMINO]-4,5,6,7-TETRAHYDROBENZO-[B]-THIOPHENE-3-CARBOXYLIC-ACID-ETHYLESTER
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H37N3O4S
InChI InChI=1S/C27H37N3O4S/c1-3-34-27(32)25-20-10-4-7-13-23(20)35-26(25)28-24(31)14-8-9-15-29-16-18-30(19-17-29)21-11-5-6-12-22(21)33-2/h5-6,11-12H,3-4,7-10,13-19H2,1-2H3,(H,28,31)
InChIKey ZPRQBRYSRONYBK-UHFFFAOYSA-N
Literature Reference Author K.M.AL-TAISAN,H.M.A.AL-HAZIMI,S.S.AL-SHIHRY
Literature Reference Citation MOLECULES,15,3932(2010)
Literature Reference DOI 10.3390/molecules15063932
Molecular Weight 499.668 g/mol
Sample ID 70947
Solvent CDCl3