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(4E,4R,5S)-5-(adenin-9-ylmethyl)-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde oxime
SpectraBase Compound ID jdyet1OTpP
InChI InChI=1S/C12H16N6O3/c1-12(2)20-7(3-17-19)8(21-12)4-18-6-16-9-10(13)14-5-15-11(9)18/h3,5-8,19H,4H2,1-2H3,(H2,13,14,15)/b17-3+/t7-,8+/m1/s1
InChIKey AXQCFZYWFGSMJA-WQXUMDFMSA-N
Mol Weight 292.3 g/mol
Molecular Formula C12H16N6O3
Exact Mass 292.128388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JONIGdjIcP
Name (4E,4R,5S)-5-(adenin-9-ylmethyl)-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde oxime
Alternate Name(s) (4E,4R,5S)-5-[(6-aminopurin-9-yl)methyl]-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde oxime (4E,4R,5S)-5-[(6-aminopurin-9-yl)methyl]-2,2-dimethyl-1,3-dioxolane-4-carboxaldehyde oxime (NE)-N-[[(4R,5S)-5-[(6-aminopurin-9-yl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]methylidene]hydroxylamine
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Formula C12H16N6O3
InChI InChI=1S/C12H16N6O3/c1-12(2)20-7(3-17-19)8(21-12)4-18-6-16-9-10(13)14-5-15-11(9)18/h3,5-8,19H,4H2,1-2H3,(H2,13,14,15)/b17-3+/t7-,8+/m1/s1
InChIKey AXQCFZYWFGSMJA-WQXUMDFMSA-N
Molecular Weight 292.299 g/mol
SMILES Nc1c2c([n](C[C@@]3(OC(O[C@@]3(\C=N\O)[H])(C)C)[H])cn2)ncn1
SPLASH splash10-000m-0970000000-41a9cdb42d896a589701
Source of Spectrum KC-0-945-9
Wiley ID 824590