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4-(3-BENZYLTHIAZOLIDIN-2-YLIDENE)-2-CYANO-3-(4-BROMOPHENYL)-BUT-2-ENENITRILE
SpectraBase Compound ID Dr8hN1PXMME
InChI InChI=1S/C21H16BrN3S/c22-19-8-6-17(7-9-19)20(18(13-23)14-24)12-21-25(10-11-26-21)15-16-4-2-1-3-5-16/h1-9,12H,10-11,15H2/b21-12-
InChIKey AWNHDRSLAZHHBL-MTJSOVHGSA-N
Mol Weight 422.34 g/mol
Molecular Formula C21H16BrN3S
Exact Mass 421.024832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8CiedrC5KRW
Name 4-(3-BENZYLTHIAZOLIDIN-2-YLIDENE)-2-CYANO-3-(4-BROMOPHENYL)-BUT-2-ENENITRILE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H16BrN3S
InChI InChI=1S/C21H16BrN3S/c22-19-8-6-17(7-9-19)20(18(13-23)14-24)12-21-25(10-11-26-21)15-16-4-2-1-3-5-16/h1-9,12H,10-11,15H2/b21-12-
InChIKey AWNHDRSLAZHHBL-MTJSOVHGSA-N
Literature Reference Author W.HANEFELD,H.HARMS
Literature Reference Citation J.HETCYCL.CHEM.,35,49(1998)
Literature Reference DOI 10.1002/jhet.5570350110
Molecular Weight 422.342 g/mol
Solvent CDCl3
Source File Reference UWCS25212