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2,4,6-Triamino-5-pyrimidinyl 3,4,5-trimethoxybenzoate
SpectraBase Compound ID 2UQ0CovUXSN
InChI InChI=1S/C14H17N5O5/c1-21-7-4-6(5-8(22-2)9(7)23-3)13(20)24-10-11(15)18-14(17)19-12(10)16/h4-5H,1-3H3,(H6,15,16,17,18,19)
InChIKey JPQMOHXMYMQELH-UHFFFAOYSA-N
Mol Weight 335.32 g/mol
Molecular Formula C14H17N5O5
Exact Mass 335.122969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13Dt6T8FMeq
Name 2,4,6-Triamino-5-pyrimidinyl 3,4,5-trimethoxybenzoate
Alternate Name(s) 2,4,6-Triaminopyrimidin-5-yl 3,4,5-trimethoxybenzoate 3,4,5-trimethoxybenzoic acid (2,4,6-triamino-5-pyrimidinyl) ester (2,4,6-triaminopyrimidin-5-yl) 3,4,5-trimethoxybenzoate [2,4,6-tris(azanyl)pyrimidin-5-yl] 3,4,5-trimethoxybenzoate
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Formula C14H17N5O5
InChI InChI=1S/C14H17N5O5/c1-21-7-4-6(5-8(22-2)9(7)23-3)13(20)24-10-11(15)18-14(17)19-12(10)16/h4-5H,1-3H3,(H6,15,16,17,18,19)
InChIKey JPQMOHXMYMQELH-UHFFFAOYSA-N
Molecular Weight 335.320 g/mol
SMILES Nc1nc(c(c(n1)N)OC(=O)c1cc(c(c(c1)OC)OC)OC)N
SPLASH splash10-0002-3900000000-8beb089ca7221e2d6280
Source of Spectrum NP-12-16-0
Wiley ID 1110027