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3-Cyano-2-ethoxy-4-phenyl-7,8,9,10-tetrahydrocyclohepteno[e]thieno[3,2-b:5,4-b']dipyridine
SpectraBase Compound ID Jq3cm0qsbzr
InChI InChI=1S/C24H21N3OS/c1-2-28-23-17(14-25)20(15-9-5-3-6-10-15)21-22-19(29-24(21)27-23)13-16-11-7-4-8-12-18(16)26-22/h3,5-6,9-10,13H,2,4,7-8,11-12H2,1H3
InChIKey NZELQIWUPYHPRG-UHFFFAOYSA-N
Mol Weight 399.51 g/mol
Molecular Formula C24H21N3OS
Exact Mass 399.140533 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDk381ZXdYX
Name 3-CYANO-2-ETHOXY-4-PHENYL-7,8,9,10-TETRAHYDROCYClOHEPTENO-[E]-THIENO-[3,2-B:5,4-B']-DIPYRIDINE
Compound Number 3 G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H21N3OS
InChI InChI=1S/C24H21N3OS/c1-2-28-23-17(14-25)20(15-9-5-3-6-10-15)21-22-19(29-24(21)27-23)13-16-11-7-4-8-12-18(16)26-22/h3,5-6,9-10,13H,2,4,7-8,11-12H2,1H3
InChIKey NZELQIWUPYHPRG-UHFFFAOYSA-N
Literature Reference Author M.C.VEIGA,J.M.QUINTELA,C.PEINADOR
Literature Reference Citation HETEROCYCLES,43,91(1996)
Literature Reference DOI 10.3987/COM-95-7222
Molecular Weight 399.510 g/mol
Solvent CDCl3
Source File Reference UWCS20509