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(+-)-[(1SR,3RS)-2,2-Difluoro-3-hydroxymethylcyclopropylmethyl]-6,9-dihydro-1H-6-purinone
SpectraBase Compound ID 3tBj8icArjl
InChI InChI=1S/C10H10F2N4O2/c11-10(12)5(6(10)2-17)1-16-4-15-7-8(16)13-3-14-9(7)18/h3-6,17H,1-2H2,(H,13,14,18)
InChIKey BTOTUVRESQJYDB-UHFFFAOYSA-N
Mol Weight 256.21 g/mol
Molecular Formula C10H10F2N4O2
Exact Mass 256.077182 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCsh2LaH1pW
Name (+-)-[(1SR,3RS)-2,2-Difluoro-3-hydroxymethylcyclopropylmethyl]-6,9-dihydro-1H-6-purinone
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Formula C10H10F2N4O2
InChI InChI=1S/C10H10F2N4O2/c11-10(12)5(6(10)2-17)1-16-4-15-7-8(16)13-3-14-9(7)18/h3-6,17H,1-2H2,(H,13,14,18)
InChIKey BTOTUVRESQJYDB-UHFFFAOYSA-N
Molecular Weight 256.213 g/mol
SMILES OCC1C(C1C[n]1cnc2c1N=CNC2=O)(F)F
SPLASH splash10-000i-2930000000-29d7b807c5981bae3500
Source of Spectrum F-54-6453-16
Synonyms (+-)-9-[(1SR,3RS)-2,2-Difluoro-3-hydroxymethylcyclopropylmethyl]-1,9-dihydro-1H-6-purinone 9-{[2,2-difluoro-3-(hydroxymethyl)cyclopropyl]methyl}-1,9-dihydro-6H-purin-6-one
Wiley ID 807422