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Methyl 2'-deoxy-5-cytidinyl)propenoate
SpectraBase Compound ID KrhFoJiAQ4H
InChI InChI=1S/C13H17N3O6/c1-21-11(19)3-2-7-5-16(13(20)15-12(7)14)10-4-8(18)9(6-17)22-10/h2-3,5,8-10,17-18H,4,6H2,1H3,(H2,14,15,20)/b3-2+
InChIKey HESLMBMKSPDPGK-NSCUHMNNSA-N
Mol Weight 311.29 g/mol
Molecular Formula C13H17N3O6
Exact Mass 311.111735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66Fhvf2trgZ
Name Methyl 2'-deoxy-5-cytidinyl)propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N3O6
InChI InChI=1S/C13H17N3O6/c1-21-11(19)3-2-7-5-16(13(20)15-12(7)14)10-4-8(18)9(6-17)22-10/h2-3,5,8-10,17-18H,4,6H2,1H3,(H2,14,15,20)/b3-2+
InChIKey HESLMBMKSPDPGK-NSCUHMNNSA-N
Molecular Weight 311.294 g/mol
SMILES NC1=NC(N(C2CC(C(O2)CO)O)C=C1\C=C\C(=O)OC)=O
SPLASH splash10-014i-0941000000-c85be303f1e6fed5e26d
Source of Spectrum AN-100-629-0
Synonyms (E)-3-[4-amino-1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-oxo-5-pyrimidinyl]-2-propenoic acid methyl ester Methyl (E)-3-[4-amino-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-5-yl]prop-2-enoate Methyl (E)-3-[4-amino-1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-5-yl]prop-2-enoate Methyl (E)-3-[4-azanyl-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-pyrimidin-5-yl]prop-2-enoate
Wiley ID 747171