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1-(2,3-o-Anhydro-.beta.-D-lyxofuranosyl)-2-piperidino-4-pyrimidone
SpectraBase Compound ID Dm17KHnOtjl
InChI InChI=1S/C14H19N3O4/c18-8-9-11-12(21-11)13(20-9)17-7-4-10(19)15-14(17)16-5-2-1-3-6-16/h4,7,9,11-13,18H,1-3,5-6,8H2/t9-,11?,12?,13-/m1/s1
InChIKey BNHHWAZDETYTHJ-SARFZWSYSA-N
Mol Weight 293.32 g/mol
Molecular Formula C14H19N3O4
Exact Mass 293.137556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LLrW87BCDCV
Name 1-(2,3-o-Anhydro-.beta.-D-lyxofuranosyl)-2-piperidino-4-pyrimidone
Comments Computed using HOSE algorithm
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Exact Mass 293.137556100 u
Formula C14H19N3O4
InChI InChI=1S/C14H19N3O4/c18-8-9-11-12(21-11)13(20-9)17-7-4-10(19)15-14(17)16-5-2-1-3-6-16/h4,7,9,11-13,18H,1-3,5-6,8H2/t9-,11?,12?,13-/m1/s1
InChIKey BNHHWAZDETYTHJ-SARFZWSYSA-N
Molecular Weight 293.323 g/mol
SMILES C12[C@](N3C(=NC(C=C3)=O)N3CCCCC3)(O[C@@](C2O1)(CO)[H])[H]