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2-CYANO-5-DIMETHYLAMINO-3-(2-ISOPROPYLPHENYL)-5-METHYLTHIOPENTA-2,4-DIENENITRILE
SpectraBase Compound ID 9o6E2HakVV9
InChI InChI=1S/C18H21N3S/c1-13(2)15-8-6-7-9-16(15)17(14(11-19)12-20)10-18(22-5)21(3)4/h6-10,13H,1-5H3/b18-10+
InChIKey UHEZRWLIJOBFBK-VCHYOVAHSA-N
Mol Weight 311.45 g/mol
Molecular Formula C18H21N3S
Exact Mass 311.145619 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7v0jc72ROMn
Name 2-CYANO-5-DIMETHYLAMINO-3-(2-ISOPROPYLPHENYL)-5-METHYLTHIOPENTA-2,4-DIENENITRILE
Compound Number 4H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H21N3S
InChI InChI=1S/C18H21N3S/c1-13(2)15-8-6-7-9-16(15)17(14(11-19)12-20)10-18(22-5)21(3)4/h6-10,13H,1-5H3/b18-10+
InChIKey UHEZRWLIJOBFBK-VCHYOVAHSA-N
Literature Reference Author T.FREIER,M.MICHALIK,K.PESEKE,H.REINKE
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1265(1999)
Literature Reference DOI 10.1039/a805857a
Molecular Weight 311.445 g/mol
Solvent CDCl3
Source File Reference UWRU10415