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2,2'-META-PHENYLENE-BIS-[4,5-DIHYDRO-5-[2-(2'-HYDROXYETHOXY)-ETHYLIMINO]-4-METHYL-1,3,4-THIADIAZOLE]
SpectraBase Compound ID 5ygAF9kVZGK
InChI InChI=1S/C20H28N6O4S2/c1-25-19(21-6-10-29-12-8-27)31-17(23-25)15-4-3-5-16(14-15)18-24-26(2)20(32-18)22-7-11-30-13-9-28/h3-5,14,27-28H,6-13H2,1-2H3/b21-19-,22-20-
InChIKey STWNTCMBMRMNCX-WRBBJXAJSA-N
Mol Weight 480.6 g/mol
Molecular Formula C20H28N6O4S2
Exact Mass 480.161346 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9QYesHL58fU
Name 2,2'-META-PHENYLENE-BIS-[4,5-DIHYDRO-5-[2-(2'-HYDROXYETHOXY)-ETHYLIMINO]-4-METHYL-1,3,4-THIADIAZOLE]
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28N6O4S2
InChI InChI=1S/C20H28N6O4S2/c1-25-19(21-6-10-29-12-8-27)31-17(23-25)15-4-3-5-16(14-15)18-24-26(2)20(32-18)22-7-11-30-13-9-28/h3-5,14,27-28H,6-13H2,1-2H3/b21-19-,22-20-
InChIKey STWNTCMBMRMNCX-WRBBJXAJSA-N
Literature Reference Author P.MOLINA,A.TARRAGA,I.DIAZ,A.ESPINOSA,C.GASPAR
Literature Reference Citation HETEROCYCLES,36,1263(1993)
Literature Reference DOI 10.3987/COM-92-6275
Molecular Weight 480.600 g/mol
Solvent CDCl3
Source File Reference UWCP6760