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8-Butyl-9-(3-mesyloxypropyl)-1-methyl-3,9-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID LyJI2ayI4AB
InChI InChI=1S/C14H22N4O5S/c1-4-5-7-10-15-11-12(16-14(20)17(2)13(11)19)18(10)8-6-9-23-24(3,21)22/h4-9H2,1-3H3,(H,16,20)
InChIKey UEAJOHWFIKQOHG-UHFFFAOYSA-N
Mol Weight 358.41 g/mol
Molecular Formula C14H22N4O5S
Exact Mass 358.131091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXTrYBFEHki
Name 8-Butyl-9-(3-mesyloxypropyl)-1-methyl-3,9-dihydro-1H-purine-2,6-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22N4O5S
InChI InChI=1S/C14H22N4O5S/c1-4-5-7-10-15-11-12(16-14(20)17(2)13(11)19)18(10)8-6-9-23-24(3,21)22/h4-9H2,1-3H3,(H,16,20)
InChIKey UEAJOHWFIKQOHG-UHFFFAOYSA-N
Molecular Weight 358.413 g/mol
SMILES N1C(N(C(c2nc([n](c12)CCCOS(=O)(=O)C)CCCC)=O)C)=O
SPLASH splash10-00di-1290000000-5d6a5109d72261aa0563
Source of Spectrum SO-0-839-9
Synonyms 3-(8-butyl-1-methyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)propyl methanesulfonate
Wiley ID 1545880