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[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl phenyl carbonate
SpectraBase Compound ID CGczs94yJxB
InChI InChI=1S/C17H18N2O7/c1-10-8-19(16(22)18-15(10)21)14-7-12(20)13(26-14)9-24-17(23)25-11-5-3-2-4-6-11/h2-6,8,12-14,20H,7,9H2,1H3,(H,18,21,22)/t12-,13+,14+/m0/s1
InChIKey SRQCEBSEXUVGCA-BFHYXJOUSA-N
Mol Weight 362.34 g/mol
Molecular Formula C17H18N2O7
Exact Mass 362.111401 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7im79HOqbAt
Name [(2R,3S,5R)-3-Hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl phenyl carbonate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.111400921 u
Formula C17H18N2O7
InChI InChI=1S/C17H18N2O7/c1-10-8-19(16(22)18-15(10)21)14-7-12(20)13(26-14)9-24-17(23)25-11-5-3-2-4-6-11/h2-6,8,12-14,20H,7,9H2,1H3,(H,18,21,22)/t12-,13+,14+/m0/s1
InChIKey SRQCEBSEXUVGCA-BFHYXJOUSA-N
Molecular Weight 362.338 g/mol
SMILES C1(N(C=C(C(N1)=O)C)[C@@]1(O[C@](COC(OC=2C=CC=CC2)=O)([C@](C1)(O)[H])[H])[H])=O