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2-amino-9-[(2R,3R,5S)-3-hydroxy-4-methylene-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one

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2-amino-9-[(2R,3R,5S)-3-hydroxy-4-methylene-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one
SpectraBase Compound ID EIwd5OV0W5R
InChI InChI=1S/C11H13N5O4/c1-4-5(2-17)20-10(7(4)18)16-3-13-6-8(16)14-11(12)15-9(6)19/h3,5,7,10,17-18H,1-2H2,(H3,12,14,15,19)/t5-,7-,10-/m1/s1
InChIKey LNDROJZTHYYPDA-VISXPRAWSA-N
Mol Weight 279.26 g/mol
Molecular Formula C11H13N5O4
Exact Mass 279.096754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcrvSFJ2t5t
Name 2-amino-9-[(2R,3R,5S)-3-hydroxy-4-methylene-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one
CAS Registry Number 141320-63-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N5O4
InChI InChI=1S/C11H13N5O4/c1-4-5(2-17)20-10(7(4)18)16-3-13-6-8(16)14-11(12)15-9(6)19/h3,5,7,10,17-18H,1-2H2,(H3,12,14,15,19)/t5-,7-,10-/m1/s1
InChIKey LNDROJZTHYYPDA-VISXPRAWSA-N
Molecular Weight 279.256 g/mol
SMILES OC[C@]1(O[C@@]([n]2c3N=C(NC(c3nc2)=O)N)([C@@](C1=C)(O)[H])[H])[H]
SPLASH splash10-0udi-0920000000-86b42434ab9335e8a7cc
Source of Spectrum E1-35-2291-30
Synonyms 2-amino-9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)-4-methylene-2-oxolanyl]-3H-purin-6-one 2-amino-9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)-4-methylene-tetrahydrofuran-2-yl]-3H-purin-6-one 2-amino-9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)-4-methylideneoxolan-2-yl]-3H-purin-6-one 2-azanyl-9-[(2R,3R,5S)-5-(hydroxymethyl)-4-methylidene-3-oxidanyl-oxolan-2-yl]-3H-purin-6-one
Wiley ID 1574311