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1,2,5-Oxadiazol-3-amine, 4-[5-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl]-
SpectraBase Compound ID 59NYA8k3fkC
InChI InChI=1S/C13H13N5O4/c1-19-8-4-3-7(5-9(8)20-2)6-10-15-13(18-21-10)11-12(14)17-22-16-11/h3-5H,6H2,1-2H3,(H2,14,17)
InChIKey NCRAEROLPUJRLK-UHFFFAOYSA-N
Mol Weight 303.28 g/mol
Molecular Formula C13H13N5O4
Exact Mass 303.096754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LOL5lmvvG2A
Name 1,2,5-Oxadiazol-3-amine, 4-[5-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N5O4
InChI InChI=1S/C13H13N5O4/c1-19-8-4-3-7(5-9(8)20-2)6-10-15-13(18-21-10)11-12(14)17-22-16-11/h3-5H,6H2,1-2H3,(H2,14,17)
InChIKey NCRAEROLPUJRLK-UHFFFAOYSA-N
Molecular Weight 303.278 g/mol
SMILES Nc1c(-c2nc(Cc3cc(OC)c(cc3)OC)on2)non1
SPLASH splash10-0udi-6946000000-9439c6b4f5832594dd42
Source of Spectrum IY-1-4337-6
Synonyms 4-[5-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Wiley ID 1651359