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4-(2-amino-6-keto-3H-purin-9-yl)butyric acid ethyl ester
SpectraBase Compound ID 42cCAGTs7VA
InChI InChI=1S/C11H15N5O3/c1-2-19-7(17)4-3-5-16-6-13-8-9(16)14-11(12)15-10(8)18/h6H,2-5H2,1H3,(H3,12,14,15,18)
InChIKey RYIUBVRBCKIMTD-UHFFFAOYSA-N
Mol Weight 265.27 g/mol
Molecular Formula C11H15N5O3
Exact Mass 265.117489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UvjXzZoZLf
Name 4-(2-amino-6-keto-3H-purin-9-yl)butyric acid ethyl ester
Alternate Name(s) 4-(2-amino-6-oxo-3H-purin-9-yl)butanoic acid ethyl ester Ethyl 4-(2-amino-6-oxo-3H-purin-9-yl)butanoate Ethyl 4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)butanoate
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Formula C11H15N5O3
InChI InChI=1S/C11H15N5O3/c1-2-19-7(17)4-3-5-16-6-13-8-9(16)14-11(12)15-10(8)18/h6H,2-5H2,1H3,(H3,12,14,15,18)
InChIKey RYIUBVRBCKIMTD-UHFFFAOYSA-N
Molecular Weight 265.273 g/mol
SMILES NC1=Nc2[n](cnc2C(N1)=O)CCCC(=O)OCC
SPLASH splash10-014i-0790000000-5eb240b3173cddd69e40
Source of Spectrum E1-44-1807-8
Wiley ID 1553515