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O-ACETYL-ISORETULINE

View entire compound with spectra: 1 NMR

O-ACETYL-ISORETULINE
SpectraBase Compound ID JGTFGaeTjY6
InChI InChI=1S/C23H28N2O3/c1-4-16-12-24-10-9-23-19-7-5-6-8-20(19)25(14(2)26)22(23)18(13-28-15(3)27)17(16)11-21(23)24/h4-8,17-18,21-22H,9-13H2,1-3H3/b16-4-/t17?,18-,21?,22+,23-/m1/s1
InChIKey PTRWORWVJKGZCI-ZDABNPBESA-N
Mol Weight 380.49 g/mol
Molecular Formula C23H28N2O3
Exact Mass 380.209993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4nmJqA6GYCY
Name O-ACETYL-ISORETULINE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28N2O3
InChI InChI=1S/C23H28N2O3/c1-4-16-12-24-10-9-23-19-7-5-6-8-20(19)25(14(2)26)22(23)18(13-28-15(3)27)17(16)11-21(23)24/h4-8,17-18,21-22H,9-13H2,1-3H3/b16-4-/t17?,18-,21?,22+,23-/m1/s1
InChIKey PTRWORWVJKGZCI-ZDABNPBESA-N
Literature Reference Author P.THEPENIER,M.J.JACQUIER,G.MASSIOT,L.L.MEN-OLIVIER,C.DELAUDE
Literature Reference Citation PHYTOCHEM.,29,686(1990)
Literature Reference DOI 10.1016/0031-9422(90)85151-5
Molecular Weight 380.487 g/mol
Solvent CDCl3
Source File Reference UWVN29399