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(E)-2-(BENZO-[D]-THIAZOL-2-YL)-3-(4-NIROPHENYL)-ACRYLONITRILE
SpectraBase Compound ID 2sMj64EG7U6
InChI InChI=1S/2C16H9N3O2S/c2*17-10-12(9-11-5-7-13(8-6-11)19(20)21)16-18-14-3-1-2-4-15(14)22-16/h2*1-9H/b2*12-9+
InChIKey SAPCOCCDPTXGKM-MTTRIGNLSA-N
Mol Weight 614.65 g/mol
Molecular Formula C32H18N6O4S2
Exact Mass 614.083095 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Mc8j38Hsi
Name (E)-2-(BENZO-[D]-THIAZOL-2-YL)-3-(4-NIROPHENYL)-ACRYLONITRILE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H18N6O4S2
InChI InChI=1S/2C16H9N3O2S/c2*17-10-12(9-11-5-7-13(8-6-11)19(20)21)16-18-14-3-1-2-4-15(14)22-16/h2*1-9H/b2*12-9+
InChIKey SAPCOCCDPTXGKM-MTTRIGNLSA-N
Literature Reference Author J.E.TRILLAERAS,K.J.VELASQUEZ,D.J.PACHECO,J.QUIROGA,A.ORTIZ
Literature Reference Citation J.BRAZ.CHEM.SOC.,22,2396(2011)
Literature Reference DOI 10.1590/s0103-50532011001200022
Molecular Weight 614.653 g/mol
Source File Reference UWBT5744