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8-cyclohexyl-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 7o7r5UmpHR0
InChI InChI=1S/C14H20N4O2/c1-16-10-12(17(2)14(20)18(3)13(10)19)15-11(16)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3
InChIKey HJRNYGSEKWPIMR-UHFFFAOYSA-N
Mol Weight 276.34 g/mol
Molecular Formula C14H20N4O2
Exact Mass 276.158626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ag8gNtfUTJP
Name 8-cyclohexyl-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Comments Less than 3 mono-isotopic peaks
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Formula C14H20N4O2
InChI InChI=1S/C14H20N4O2/c1-16-10-12(17(2)14(20)18(3)13(10)19)15-11(16)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3
InChIKey HJRNYGSEKWPIMR-UHFFFAOYSA-N
Molecular Weight 276.340 g/mol
SMILES c12c(N(C)C(N(C2=O)C)=O)nc([n]1C)C1CCCCC1
SPLASH splash10-00b9-0090000000-8787db5c6431b4640de9
Source of Spectrum AJ-65-2048-5
Synonyms 8-cyclohexyl-1,3,7-trimethyl-purine-2,6-dione 8-cyclohexyl-1,3,7-trimethyl-xanthine
Wiley ID 771496