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2,2'-[4,4'-(HEXANE-1,4-DIYL)-BIS-(3-METHYL-5-OXO-4,5-DIHYDRO-1,2,4-TRIAZOLE-4,1-DIYL)]-DIACETOHYDRAZIDE
SpectraBase Compound ID JDxJeh8aqDq
InChI InChI=1S/C16H28N10O4/c1-11-21-25(9-13(27)19-17)15(29)23(11)7-5-3-4-6-8-24-12(2)22-26(16(24)30)10-14(28)20-18/h3-10,17-18H2,1-2H3,(H,19,27)(H,20,28)
InChIKey FCRLIEJDOQZMHD-UHFFFAOYSA-N
Mol Weight 424.47 g/mol
Molecular Formula C16H28N10O4
Exact Mass 424.229499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5fzbBqTyCfH
Name 2,2'-[4,4'-(HEXANE-1,4-DIYL)-BIS-(3-METHYL-5-OXO-4,5-DIHYDRO-1,2,4-TRIAZOLE-4,1-DIYL)]-DIACETOHYDRAZIDE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28N10O4
InChI InChI=1S/C16H28N10O4/c1-11-21-25(9-13(27)19-17)15(29)23(11)7-5-3-4-6-8-24-12(2)22-26(16(24)30)10-14(28)20-18/h3-10,17-18H2,1-2H3,(H,19,27)(H,20,28)
InChIKey FCRLIEJDOQZMHD-UHFFFAOYSA-N
Literature Reference Author E.DUGDU,Y.UNVER,D.UNLUER,K.SANCAK
Literature Reference Citation MOLECULES,19,2199(2014)
Literature Reference DOI 10.3390/molecules19022199
Molecular Weight 424.463 g/mol
Solvent DMSO-D6
Source File Reference UWBT14597