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5-OXO-4-PHENYLAMINO-3-N-PROPYL-4,5-DIHYDRO-[1,2,4]-TRIAZOL-1-YL-ACETIC-ACID-4-HYDROXY-3-METHOXY-BENZYLIDENE-HYDRAZIDE
SpectraBase Compound ID FhuPDm9e3J7
InChI InChI=1S/2C21H24N6O4/c2*1-3-7-19-25-26(21(30)27(19)24-16-8-5-4-6-9-16)14-20(29)23-22-13-15-10-11-17(28)18(12-15)31-2/h2*4-6,8-13,24,28H,3,7,14H2,1-2H3,(H,23,29)/b2*22-13+
InChIKey YFAUZRGLGQDGMG-JOJWOGBXSA-N
Mol Weight 848.92 g/mol
Molecular Formula C42H48N12O8
Exact Mass 848.371807 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJBxJHZXkAS
Name 5-OXO-4-PHENYLAMINO-3-N-PROPYL-4,5-DIHYDRO-[1,2,4]-TRIAZOL-1-YL-ACETIC-ACID-4-HYDROXY-3-METHOXY-BENZYLIDENE-HYDRAZIDE
Compound Number 10C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H48N12O8
InChI InChI=1S/2C21H24N6O4/c2*1-3-7-19-25-26(21(30)27(19)24-16-8-5-4-6-9-16)14-20(29)23-22-13-15-10-11-17(28)18(12-15)31-2/h2*4-6,8-13,24,28H,3,7,14H2,1-2H3,(H,23,29)/b2*22-13+
InChIKey YFAUZRGLGQDGMG-JOJWOGBXSA-N
Literature Reference Author A.DEMIRBAS
Literature Reference Citation TURK.J.CHEM.,28,311(2004)
Molecular Weight 848.919 g/mol
Solvent DMSO-D6
Source File Reference UWLU5946