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2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)-N,N-dipropylacetamide
SpectraBase Compound ID GARR68bikM0
InChI InChI=1S/C15H23N5O3/c1-5-7-19(8-6-2)11(21)9-20-10-16-13-12(20)14(22)18(4)15(23)17(13)3/h10H,5-9H2,1-4H3
InChIKey XXUIJNWREZALIF-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C15H23N5O3
Exact Mass 321.18009 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 50BnoEWs71e
Name 2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)-N,N-dipropylacetamide
Comments Computed using HOSE algorithm
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Exact Mass 321.180089618 u
Formula C15H23N5O3
InChI InChI=1S/C15H23N5O3/c1-5-7-19(8-6-2)11(21)9-20-10-16-13-12(20)14(22)18(4)15(23)17(13)3/h10H,5-9H2,1-4H3
InChIKey XXUIJNWREZALIF-UHFFFAOYSA-N
Molecular Weight 321.381 g/mol
SMILES C1(N(C(C2=C(N1C)N=CN2CC(N(CCC)CCC)=O)=O)C)=O