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Diisopropyl{2-[(6-cyclohexylamino)-2-amino-9H-purine-9-yl]ethoxy}methyl-phosphonate
SpectraBase Compound ID 4JRHmdvdxrX
InChI InChI=1S/C20H35N6O4P/c1-14(2)29-31(27,30-15(3)4)13-28-11-10-26-12-22-17-18(24-20(21)25-19(17)26)23-16-8-6-5-7-9-16/h12,14-16H,5-11,13H2,1-4H3,(H3,21,23,24,25)
InChIKey JBRNUPFKXBZBOQ-UHFFFAOYSA-N
Mol Weight 454.5 g/mol
Molecular Formula C20H35N6O4P
Exact Mass 454.245741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DO2f1Mp4Mby
Name Diisopropyl{2-[(6-cyclohexylamino)-2-amino-9H-purine-9-yl]ethoxy}methyl-phosphonate
Alternate Name(s) Diisopropyl ((2-(2-amino-6-(cyclohexylamino)-9H-purin-9-yl)ethoxy)methyl)phosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H35N6O4P
InChI InChI=1S/C20H35N6O4P/c1-14(2)29-31(27,30-15(3)4)13-28-11-10-26-12-22-17-18(24-20(21)25-19(17)26)23-16-8-6-5-7-9-16/h12,14-16H,5-11,13H2,1-4H3,(H3,21,23,24,25)
InChIKey JBRNUPFKXBZBOQ-UHFFFAOYSA-N
Molecular Weight 454.512 g/mol
SMILES Nc1nc2c(c(n1)NC1CCCCC1)nc[n]2CCOCP(=O)(OC(C)C)OC(C)C
SPLASH splash10-0ufu-3981500000-83d526bb6fc9c639a34c
Source of Spectrum F-69-687-9o
Wiley ID 1737684