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5-(2-Carboxyethyl)-cytidine

View entire compound with spectra: 2 NMR

5-(2-Carboxyethyl)-cytidine
SpectraBase Compound ID 4641bE99pt9
InChI InChI=1S/C12H17N3O7/c13-10-5(1-2-7(17)18)3-15(12(21)14-10)11-9(20)8(19)6(4-16)22-11/h3,6,8-9,11,16,19-20H,1-2,4H2,(H,17,18)(H2,13,14,21)
InChIKey XFAHZAHFLPDONY-UHFFFAOYSA-N
Mol Weight 315.28 g/mol
Molecular Formula C12H17N3O7
Exact Mass 315.10665 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H04Cwe9X3Mr
Name 5-(2-Carboxyethyl)-cytidine
CAS Registry Number 81206-85-1
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H17N3O7
InChI InChI=1S/C12H17N3O7/c13-10-5(1-2-7(17)18)3-15(12(21)14-10)11-9(20)8(19)6(4-16)22-11/h3,6,8-9,11,16,19-20H,1-2,4H2,(H,17,18)(H2,13,14,21)
InChIKey XFAHZAHFLPDONY-UHFFFAOYSA-N
Instrument Name SF = 100 MHz
Literature Reference J. Org. Chem. 47, 2174 (1982).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O