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1,2,4-Oxadiazol-5-amine, 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(3,4-dimethoxyphenyl)methyl]-
SpectraBase Compound ID dD2Uo9kOIu
InChI InChI=1S/C13H14N6O4/c1-20-8-4-3-7(5-9(8)21-2)6-15-13-16-12(19-22-13)10-11(14)18-23-17-10/h3-5H,6H2,1-2H3,(H2,14,18)(H,15,16,19)
InChIKey NLNMGFUBEWATPJ-UHFFFAOYSA-N
Mol Weight 318.29 g/mol
Molecular Formula C13H14N6O4
Exact Mass 318.107653 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12Lixr4vGKy
Name 1,2,4-Oxadiazol-5-amine, 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(3,4-dimethoxyphenyl)methyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N6O4
InChI InChI=1S/C13H14N6O4/c1-20-8-4-3-7(5-9(8)21-2)6-15-13-16-12(19-22-13)10-11(14)18-23-17-10/h3-5H,6H2,1-2H3,(H2,14,18)(H,15,16,19)
InChIKey NLNMGFUBEWATPJ-UHFFFAOYSA-N
Molecular Weight 318.293 g/mol
SMILES Nc1nonc1-c1nc(on1)NCc1cc(c(cc1)OC)OC
SPLASH splash10-0udi-5900000000-61ae93baa334e4163f73
Source of Spectrum IY-2-4798-7
Synonyms 4-[5-[(3,4-dimethoxyphenyl)methylamino]-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Wiley ID 1655970