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5-(3-BROMO-2-THIENYL)-2-CYANO-5-OXO-3-PHENYLVALERONITRILE
SpectraBase Compound ID ECYKbXNouxa
InChI InChI=1S/C16H11BrN2OS/c17-14-6-7-21-16(14)15(20)8-13(12(9-18)10-19)11-4-2-1-3-5-11/h1-7,12-13H,8H2
InChIKey KWLUMZADVGNLFA-UHFFFAOYSA-N
Mol Weight 359.24 g/mol
Molecular Formula C16H11BrN2OS
Exact Mass 357.977547 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CNWN68lRFGM
Name 5-(3-BROMO-2-THIENYL)-2-CYANO-5-OXO-3-PHENYLVALERONITRILE
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11BrN2OS
InChI InChI=1S/C16H11BrN2OS/c17-14-6-7-21-16(14)15(20)8-13(12(9-18)10-19)11-4-2-1-3-5-11/h1-7,12-13H,8H2
InChIKey KWLUMZADVGNLFA-UHFFFAOYSA-N
Literature Reference Author L.GREINER-BECHERT,T.SPRANG,H.H.OTTO
Literature Reference Citation MH.CHEM.,136,635(2005)
Literature Reference DOI 10.1007/s00706-004-0265-8
Molecular Weight 359.240 g/mol
Solvent CDCl3
Source File Reference UWMZ18818