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2,5-Di(methylamino)terephthalic acid 1-(3-azidopropyl)amide 4-methylester
SpectraBase Compound ID 1D1WnH8KeFd
InChI InChI=1S/C14H20N6O3/c1-16-11-8-10(14(22)23-3)12(17-2)7-9(11)13(21)18-5-4-6-19-20-15/h7-8,16-17H,4-6H2,1-3H3,(H,18,21)
InChIKey YGSWODROWHVNAK-UHFFFAOYSA-N
Mol Weight 320.35 g/mol
Molecular Formula C14H20N6O3
Exact Mass 320.159689 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G94YADOv8Jw
Name 2,5-Di(methylamino)terephthalic acid 1-(3-azidopropyl)amide 4-methylester
Appearance Red solid
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Exact Mass 320.159688525 u
Formula C14H20N6O3
InChI InChI=1S/C14H20N6O3/c1-16-11-8-10(14(22)23-3)12(17-2)7-9(11)13(21)18-5-4-6-19-20-15/h7-8,16-17H,4-6H2,1-3H3,(H,18,21)
InChIKey YGSWODROWHVNAK-UHFFFAOYSA-N
Instrument Name Thermo Scientific DFS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201700774
Molecular Weight 320.353 g/mol
Quality 62
Reported Formula C14H20N6O3
SMILES N(C(C=1C=C(C(=CC1NC)C(=O)OC)NC)=O)CCCN=[N+]=[N-]
SPLASH splash10-00di-0796000000-b4d5059716680add682d
Source of Spectrum QE-23-6540-6 (DOI: 10.1002/chem.201700774)
Thin-Layer Chromatography 0.20 (SiO2, hexane/MTBE, 1:3)
Wiley ID 1905465