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Diisopropyl{2-[2-amino-6-(n-octylamino)-7H-purine-7-yl]ethoxy}methylphosphonate
SpectraBase Compound ID EiWEU44mG3U
InChI InChI=1S/C22H41N6O4P/c1-6-7-8-9-10-11-12-24-20-19-21(27-22(23)26-20)25-15-28(19)13-14-30-16-33(29,31-17(2)3)32-18(4)5/h15,17-18H,6-14,16H2,1-5H3,(H3,23,24,26,27)
InChIKey IYLARJKYYGQWET-UHFFFAOYSA-N
Mol Weight 484.6 g/mol
Molecular Formula C22H41N6O4P
Exact Mass 484.292691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6EsY2t32pz
Name Diisopropyl{2-[2-amino-6-(n-octylamino)-7H-purine-7-yl]ethoxy}methylphosphonate
Alternate Name(s) Diisopropyl ((2-(2-amino-6-(octylamino)-7H-purin-7-yl)ethoxy)methyl)phosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H41N6O4P
InChI InChI=1S/C22H41N6O4P/c1-6-7-8-9-10-11-12-24-20-19-21(27-22(23)26-20)25-15-28(19)13-14-30-16-33(29,31-17(2)3)32-18(4)5/h15,17-18H,6-14,16H2,1-5H3,(H3,23,24,26,27)
InChIKey IYLARJKYYGQWET-UHFFFAOYSA-N
Molecular Weight 484.582 g/mol
SMILES Nc1nc(c2c(n1)nc[n]2CCOCP(=O)(OC(C)C)OC(C)C)NCCCCCCCC
SPLASH splash10-000f-6955100000-d662f34cbec511bff791
Source of Spectrum F-69-689-10g
Wiley ID 1737674