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N,N-BIS-{[4-(2-THIENYL)-1H-PYRROL-2-YL]-METHYL}-1-BUTANAMINE
SpectraBase Compound ID IVR5xW8JFHB
InChI InChI=1S/C22H25N3S2/c1-2-3-8-25(15-19-11-17(13-23-19)21-6-4-9-26-21)16-20-12-18(14-24-20)22-7-5-10-27-22/h4-7,9-14,23-24H,2-3,8,15-16H2,1H3
InChIKey PQFTVNPRKRJPTP-UHFFFAOYSA-N
Mol Weight 395.58 g/mol
Molecular Formula C22H25N3S2
Exact Mass 395.14899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ai01XTaK3fj
Name N,N-BIS-{[4-(2-THIENYL)-1H-PYRROL-2-YL]-METHYL}-1-BUTANAMINE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25N3S2
InChI InChI=1S/C22H25N3S2/c1-2-3-8-25(15-19-11-17(13-23-19)21-6-4-9-26-21)16-20-12-18(14-24-20)22-7-5-10-27-22/h4-7,9-14,23-24H,2-3,8,15-16H2,1H3
InChIKey PQFTVNPRKRJPTP-UHFFFAOYSA-N
Literature Reference Author R.A.DAVIS,A.R.CARROLL,R.J.QUINN
Literature Reference Citation AUSTR.J.CHEM.,55,789(2002)
Literature Reference DOI 10.1071/CH02110
Molecular Weight 395.581 g/mol
Solvent DMSO-D6
Source File Reference UWKP3361