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1-Thymine-2-deoxy-.beta.-D-ribofuranos-5-yl 2-Propenoate
SpectraBase Compound ID 3f7oXXNjGOZ
InChI InChI=1S/C13H16N2O6/c1-3-11(17)20-6-9-8(16)4-10(21-9)15-5-7(2)12(18)14-13(15)19/h3,5,8-10,16H,1,4,6H2,2H3,(H,14,18,19)/t8-,9+,10?/m0/s1
InChIKey JUYPXVFOZUDZQX-QIIDTADFSA-N
Mol Weight 296.28 g/mol
Molecular Formula C13H16N2O6
Exact Mass 296.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbKa8zLRUgL
Name 1-Thymine-2-deoxy-.beta.-D-ribofuranos-5-yl 2-Propenoate
Alternate Name(s) [(2R,3S)-3-hydroxy-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl prop-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O6
InChI InChI=1S/C13H16N2O6/c1-3-11(17)20-6-9-8(16)4-10(21-9)15-5-7(2)12(18)14-13(15)19/h3,5,8-10,16H,1,4,6H2,2H3,(H,14,18,19)/t8-,9+,10?/m0/s1
InChIKey JUYPXVFOZUDZQX-QIIDTADFSA-N
Molecular Weight 296.279 g/mol
SMILES N1C(C(=CN(C2C[C@@]([C@](O2)(COC(C=C)=O)[H])(O)[H])C1=O)C)=O
SPLASH splash10-0a59-9100000000-71079c0384d1fd9be5cb
Source of Spectrum J-58-659-3
Wiley ID 1298712