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7-(2-hydroxy-3-morpholinopropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
SpectraBase Compound ID GpsvGQQXMn3
InChI InChI=1S/C18H28N6O5/c1-20-15-14(16(26)21(2)18(20)27)24(17(19-15)23-5-9-29-10-6-23)12-13(25)11-22-3-7-28-8-4-22/h13,25H,3-12H2,1-2H3
InChIKey BWJOZOZESBZIAO-UHFFFAOYSA-N
Mol Weight 408.46 g/mol
Molecular Formula C18H28N6O5
Exact Mass 408.212118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID iE9yKRW4Nx
Name 7-(2-hydroxy-3-morpholinopropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
Alternate Name(s) 7-(2-Hydroxy-3-morpholinopropyl)-8-morpholinotheophylline 7-[2-hydroxy-3-(4-morpholinyl)propyl]-1,3-dimethyl-8-(4-morpholinyl)purine-2,6-dione 7-(2-hydroxy-3-morpholin-4-ylpropyl)-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione 7-(2-hydroxy-3-morpholino-propyl)-1,3-dimethyl-8-morpholino-purine-2,6-dione 1,3-Dimethyl-8-morpholin-4-yl-7-(3-morpholin-4-yl-2-oxidanyl-propyl)purine-2,6-dione
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Formula C18H28N6O5
InChI InChI=1S/C18H28N6O5/c1-20-15-14(16(26)21(2)18(20)27)24(17(19-15)23-5-9-29-10-6-23)12-13(25)11-22-3-7-28-8-4-22/h13,25H,3-12H2,1-2H3
InChIKey BWJOZOZESBZIAO-UHFFFAOYSA-N
Molecular Weight 408.459 g/mol
SMILES OC(C[n]1c2c(nc1N1CCOCC1)N(C(N(C)C2=O)=O)C)CN1CCOCC1
SPLASH splash10-0zi0-0903000000-ee9799e77b149f3616a5
Source of Spectrum Y-46-193-4
Wiley ID 1667303