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4'(S)-1-(2,3-O-Cyclohexylidene-4-O-methyl.beta.-D-erythro-pentofuranosyl-4-ulose)-uracil
SpectraBase Compound ID JRnt6jPntQw
InChI InChI=1S/C16H22N2O7/c1-22-16(9-19)12-11(23-15(24-12)6-3-2-4-7-15)13(25-16)18-8-5-10(20)17-14(18)21/h5,8,11-13,19H,2-4,6-7,9H2,1H3,(H,17,20,21)/t11-,12+,13-,16+/m1/s1
InChIKey JWPHMYUNWFXMBR-IATRGZMQSA-N
Mol Weight 354.36 g/mol
Molecular Formula C16H22N2O7
Exact Mass 354.142701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IgFcEIXsHAk
Name 4'(S)-1-(2,3-O-CYCLOHEXYLIDENE-4-O-METHYL-BETA-D-ERYTHRO-PENTOFURANOSYL-4-ULOSE)-URACIL
Compound Number 17C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22N2O7
InChI InChI=1S/C16H22N2O7/c1-22-16(9-19)12-11(23-15(24-12)6-3-2-4-7-15)13(25-16)18-8-5-10(20)17-14(18)21/h5,8,11-13,19H,2-4,6-7,9H2,1H3,(H,17,20,21)/t11-,12+,13-,16+/m1/s1
InChIKey JWPHMYUNWFXMBR-IATRGZMQSA-N
Literature Reference Author S.L.COOK,J.A.SECRIST
Literature Reference Citation J.AM.CHEM.SOC.,101,1554(1979)
Literature Reference DOI 10.1021/ja00500a031
Molecular Weight 354.360 g/mol
Solvent PYRIDINE-D5
Source File Reference UWCS10714