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Diisopropyl{2-[6-(1-hydroxybutan-2-yl-amino)-2-amino-9H-purine-9-yl]ethoxy}methylphosphonate
SpectraBase Compound ID 2AWT8pCfWxh
InChI InChI=1S/C18H33N6O5P/c1-6-14(9-25)21-16-15-17(23-18(19)22-16)24(10-20-15)7-8-27-11-30(26,28-12(2)3)29-13(4)5/h10,12-14,25H,6-9,11H2,1-5H3,(H3,19,21,22,23)
InChIKey MEZAIEGTACWXFX-UHFFFAOYSA-N
Mol Weight 444.5 g/mol
Molecular Formula C18H33N6O5P
Exact Mass 444.225005 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BST4ta1HiaX
Name Diisopropyl{2-[6-(1-hydroxybutan-2-yl-amino)-2-amino-9H-purine-9-yl]ethoxy}methylphosphonate
Alternate Name(s) Diisopropyl{2-[6-(1-hydroxybutan-2-yl-amino)-2-amino-9Hpurine-9-yl]ethoxy}methylphosphonate Diisopropyl ((2-(2-amino-6-((1-hydroxybutan-2-yl)amino)-9H-purin-9-yl)ethoxy)methyl)phosphonate
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Formula C18H33N6O5P
InChI InChI=1S/C18H33N6O5P/c1-6-14(9-25)21-16-15-17(23-18(19)22-16)24(10-20-15)7-8-27-11-30(26,28-12(2)3)29-13(4)5/h10,12-14,25H,6-9,11H2,1-5H3,(H3,19,21,22,23)
InChIKey MEZAIEGTACWXFX-UHFFFAOYSA-N
Molecular Weight 444.473 g/mol
SMILES N(c1nc(nc2c1nc[n]2CCOCP(=O)(OC(C)C)OC(C)C)N)C(CO)CC
SPLASH splash10-01ow-5914300000-0e6642e664c090701d3b
Source of Spectrum F-69-688-9s
Wiley ID 1737476