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4-Hydroxy-1-[4-(hydroxymethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]-5-methylpyrimidin-2-one
SpectraBase Compound ID 1k0pFlH4rNG
InChI InChI=1S/C10H12N2O5/c1-4-2-12(10(15)11-8(4)14)9-7-6(17-7)5(3-13)16-9/h2,5-7,9,13H,3H2,1H3,(H,11,14,15)
InChIKey AXBTVCCVDAUCIY-UHFFFAOYSA-N
Mol Weight 240.21 g/mol
Molecular Formula C10H12N2O5
Exact Mass 240.074621 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L1xuOToCN6
Name 4-Hydroxy-1-[4-(hydroxymethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]-5-methylpyrimidin-2-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.074621489 u
Formula C10H12N2O5
InChI InChI=1S/C10H12N2O5/c1-4-2-12(10(15)11-8(4)14)9-7-6(17-7)5(3-13)16-9/h2,5-7,9,13H,3H2,1H3,(H,11,14,15)
InChIKey AXBTVCCVDAUCIY-UHFFFAOYSA-N
Molecular Weight 240.215 g/mol
SMILES CC1=CN(C2OC(C3C2O3)CO)C(N=C1O)=O