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2,5-BIS-[(4-AMINO-2,4-DIHYDRO-1,2,4-TRIAZOL-3-THIONE-5-YL)-PROPYLTHIO]-1,3,4-THIADIAZOLE
SpectraBase Compound ID 6D5cclxgAjh
InChI InChI=1S/C12H18N10S5/c13-21-7(15-17-9(21)23)3-1-5-25-11-19-20-12(27-11)26-6-2-4-8-16-18-10(24)22(8)14/h1-6,13-14H2,(H,17,23)(H,18,24)
InChIKey ZEGVUSKIYIFOEG-UHFFFAOYSA-N
Mol Weight 462.6 g/mol
Molecular Formula C12H18N10S5
Exact Mass 462.031946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C7uUALlsjly
Name 2,5-BIS-[(4-AMINO-2,4-DIHYDRO-1,2,4-TRIAZOL-3-THIONE-5-YL)-PROPYLTHIO]-1,3,4-THIADIAZOLE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18N10S5
InChI InChI=1S/C12H18N10S5/c13-21-7(15-17-9(21)23)3-1-5-25-11-19-20-12(27-11)26-6-2-4-8-16-18-10(24)22(8)14/h1-6,13-14H2,(H,17,23)(H,18,24)
InChIKey ZEGVUSKIYIFOEG-UHFFFAOYSA-N
Literature Reference Author N.REZKI,A.M.AL-YAHYAWI,S.K.BARDAWEEL,F.F.AL-BLEWI,M.R.AOUAD
Literature Reference Citation MOLECULES,20,16048(2015)
Literature Reference DOI 10.3390/molecules200916048
Molecular Weight 462.642 g/mol
Solvent Unknown
Source File Reference UWPA5126