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2-Amino-7-(2,3-dihydroxypropyl)-3H-purin-6-one
SpectraBase Compound ID F31AgH5KVLk
InChI InChI=1S/C8H11N5O3/c9-8-11-6-5(7(16)12-8)13(3-10-6)1-4(15)2-14/h3-4,14-15H,1-2H2,(H3,9,11,12,16)
InChIKey CITNURIPFANLSS-UHFFFAOYSA-N
Mol Weight 225.21 g/mol
Molecular Formula C8H11N5O3
Exact Mass 225.086189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9DrA0PkfBE
Name 2-Amino-7-(2,3-dihydroxypropyl)-3H-purin-6-one
Alternate Name(s) 2-Amino-7-glyceryl-3H-purin-6-one 2-Azanyl-7-[2,3-bis(oxidanyl)propyl]-3H-purin-6-one
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Formula C8H11N5O3
InChI InChI=1S/C8H11N5O3/c9-8-11-6-5(7(16)12-8)13(3-10-6)1-4(15)2-14/h3-4,14-15H,1-2H2,(H3,9,11,12,16)
InChIKey CITNURIPFANLSS-UHFFFAOYSA-N
Molecular Weight 225.208 g/mol
SMILES N1C(c2[n](CC(CO)O)cnc2N=C1N)=O
SPLASH splash10-004i-0290000000-e799863c095a9bb14204
Source of Spectrum O-28-552-0
Wiley ID 1226132