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2-[2-Hydroxyethyl]-9-[.beta.-d-ribofuranosyl]hypoxanthine
SpectraBase Compound ID KNRlcmdMGvM
InChI InChI=1S/C12H16N4O6/c17-2-1-6-14-10-7(11(21)15-6)13-4-16(10)12-9(20)8(19)5(3-18)22-12/h4-5,8-9,12,17-20H,1-3H2,(H,14,15,21)
InChIKey YOIJQWUBBDWNNF-UHFFFAOYSA-N
Mol Weight 312.28 g/mol
Molecular Formula C12H16N4O6
Exact Mass 312.106984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QUk77mB3sX
Name 2-[2-Hydroxyethyl]-9-[.beta.-d-ribofuranosyl]hypoxanthine
Alternate Name(s) 9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-(2-hydroxyethyl)-3H-purin-6-one 9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-(2-hydroxyethyl)-3H-purin-6-one 9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-(2-hydroxyethyl)-3H-purin-6-one 2-(2-hydroxyethyl)-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purin-6-one
CAS Registry Number 110851-59-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N4O6
InChI InChI=1S/C12H16N4O6/c17-2-1-6-14-10-7(11(21)15-6)13-4-16(10)12-9(20)8(19)5(3-18)22-12/h4-5,8-9,12,17-20H,1-3H2,(H,14,15,21)
InChIKey YOIJQWUBBDWNNF-UHFFFAOYSA-N
Molecular Weight 312.282 g/mol
SMILES N1C(=Nc2[n](C3OC(C(C3O)O)CO)cnc2C1=O)CCO
SPLASH splash10-052f-9200000000-d4753d1a0c91ba8f47b6
Source of Spectrum NP-10-7498-0
Wiley ID 1109124