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N-(PHENOXATHIIN-2-CARBONYL)-N'-(4-THIOCYANATOPHENYL)-THIOUREA
SpectraBase Compound ID CsqbVaHiWE9
InChI InChI=1S/C21H13N3O2S3/c22-12-28-15-8-6-14(7-9-15)23-21(27)24-20(25)13-5-10-17-19(11-13)29-18-4-2-1-3-16(18)26-17/h1-11H,(H2,23,24,25,27)
InChIKey UOXKFTHOOXGDQL-UHFFFAOYSA-N
Mol Weight 435.53 g/mol
Molecular Formula C21H13N3O2S3
Exact Mass 435.01699 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LbOH9sdzKQ4
Name N-(PHENOXATHIIN-2-CARBONYL)-N'-(4-THIOCYANATOPHENYL)-THIOUREA
Compound Number XIV
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H13N3O2S3
InChI InChI=1S/C21H13N3O2S3/c22-12-28-15-8-6-14(7-9-15)23-21(27)24-20(25)13-5-10-17-19(11-13)29-18-4-2-1-3-16(18)26-17/h1-11H,(H2,23,24,25,27)
InChIKey UOXKFTHOOXGDQL-UHFFFAOYSA-N
Literature Reference Author N.BADICU,T.LOLOIU,D.GAVRILIU,G.LOLOIU,O.MAIOR
Literature Reference Citation CHEM.HET.COMP.,35,1474(1999)
Literature Reference DOI 10.1007/bf02251824
Molecular Weight 435.533 g/mol
Solvent Unknown
Source File Reference UWMZ15373