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9-(3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-8-morpholino-1H-purin-6(9H)-one

View entire compound with spectra: 2 NMR

9-(3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-8-morpholino-1H-purin-6(9H)-one
SpectraBase Compound ID A6VsAXTeiM
InChI InChI=1S/C14H19N5O6/c20-5-7-9(21)10(22)13(25-7)19-11-8(12(23)16-6-15-11)17-14(19)18-1-3-24-4-2-18/h6-7,9-10,13,20-22H,1-5H2,(H,15,16,23)/t7-,9-,10-,13-/m1/s1
InChIKey JQVIHFVVMMXNPV-QYVSTXNMSA-N
Mol Weight 353.34 g/mol
Molecular Formula C14H19N5O6
Exact Mass 353.133533 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AIdRZvvRaPQ
Name 9-(3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-8-morpholino-1H-purin-6(9H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.133533346 u
Formula C14H19N5O6
InChI InChI=1S/C14H19N5O6/c20-5-7-9(21)10(22)13(25-7)19-11-8(12(23)16-6-15-11)17-14(19)18-1-3-24-4-2-18/h6-7,9-10,13,20-22H,1-5H2,(H,15,16,23)/t7-,9-,10-,13-/m1/s1
InChIKey JQVIHFVVMMXNPV-QYVSTXNMSA-N
Molecular Weight 353.335 g/mol
SMILES N1C(C=2N=C(N([C@]3([C@@]([C@@]([C@](O3)(CO)[H])(O)[H])(O)[H])[H])C2N=C1)N1CCOCC1)=O