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2-(hydroxymethyl)-5-[7-(3-methylbut-2-enylamino)-2H-pyrazolo[4,3-d]pyrimidin-3-yl]oxolane-3,4-diol
SpectraBase Compound ID FhLGxj4R1w3
InChI InChI=1S/C15H21N5O4/c1-7(2)3-4-16-15-11-9(17-6-18-15)10(19-20-11)14-13(23)12(22)8(5-21)24-14/h3,6,8,12-14,21-23H,4-5H2,1-2H3,(H,19,20)(H,16,17,18)
InChIKey LCBIXIQLEFOKCN-UHFFFAOYSA-N
Mol Weight 335.36 g/mol
Molecular Formula C15H21N5O4
Exact Mass 335.159354 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EGYcJzEAqxw
Name 2-(Hydroxymethyl)-5-[7-(3-methylbut-2-enylamino)-2H-pyrazolo[4,3-D]pyrimidin-3-yl]oxolane-3,4-diol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.159354172 u
Formula C15H21N5O4
InChI InChI=1S/C15H21N5O4/c1-7(2)3-4-16-15-11-9(17-6-18-15)10(19-20-11)14-13(23)12(22)8(5-21)24-14/h3,6,8,12-14,21-23H,4-5H2,1-2H3,(H,19,20)(H,16,17,18)
InChIKey LCBIXIQLEFOKCN-UHFFFAOYSA-N
Molecular Weight 335.364 g/mol
SMILES C1(C(C(OC1CO)C=1C=2C(=C(NCC=C(C)C)N=CN2)NN1)O)O