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7-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-1,3-dimethyl-8-piperidin-1-yl-purine-2,6-dione
SpectraBase Compound ID A8fKQjaqsZw
InChI InChI=1S/C21H25N5O4/c1-23-18-17(19(28)24(2)21(23)29)26(20(22-18)25-10-5-4-6-11-25)13-16(27)14-8-7-9-15(12-14)30-3/h7-9,12H,4-6,10-11,13H2,1-3H3
InChIKey KFTZHZWIJLZRRJ-UHFFFAOYSA-N
Mol Weight 411.46 g/mol
Molecular Formula C21H25N5O4
Exact Mass 411.190654 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8qDQPQLYAAe
Name 7-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-1,3-dimethyl-8-piperidin-1-yl-purine-2,6-dione
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Formula C21H25N5O4
InChI InChI=1S/C21H25N5O4/c1-23-18-17(19(28)24(2)21(23)29)26(20(22-18)25-10-5-4-6-11-25)13-16(27)14-8-7-9-15(12-14)30-3/h7-9,12H,4-6,10-11,13H2,1-3H3
InChIKey KFTZHZWIJLZRRJ-UHFFFAOYSA-N
Molecular Weight 411.462 g/mol
SMILES c12c([n](CC(c3cc(OC)ccc3)=O)c(n1)N1CCCCC1)C(=O)N(C(N2C)=O)C
SPLASH splash10-03di-9550000000-b6e55937af7a9032628f
Synonyms 7-[2-(3-methoxyphenyl)-2-oxo-ethyl]-1,3-dimethyl-8-(1-piperidyl)purine-2,6-dione 7-[2-(3-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(1-piperidinyl)purine-2,6-dione 7-[2-(3-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-piperidin-1-ylpurine-2,6-dione 7-[2-keto-2-(3-methoxyphenyl)ethyl]-1,3-dimethyl-8-piperidino-xanthine
Wiley ID 1457963