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3-ACETYL-5-(2'-O-ACETYL-3'-DEOXY-3'-ISOTHIOCYANATO-ALPHA-L-THREOFURANOSYL)-2-METHYLPYRROLE

View entire compound with spectra: 1 NMR

3-ACETYL-5-(2'-O-ACETYL-3'-DEOXY-3'-ISOTHIOCYANATO-ALPHA-L-THREOFURANOSYL)-2-METHYLPYRROLE
SpectraBase Compound ID CLkmBvzRAop
InChI InChI=1S/C14H16N2O4S/c1-7-10(8(2)17)4-11(16-7)13-14(20-9(3)18)12(5-19-13)15-6-21/h4,12-14,16H,5H2,1-3H3/t12-,13-,14+/m1/s1
InChIKey IISWFUYWXXIWJJ-MCIONIFRSA-N
Mol Weight 308.35 g/mol
Molecular Formula C14H16N2O4S
Exact Mass 308.083078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DGssMPgsGrO
Name 3-ACETYL-5-(2'-O-ACETYL-3'-DEOXY-3'-ISOTHIOCYANATO-ALPHA-L-THREOFURANOSYL)-2-METHYLPYRROLE
Compound Number 50
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16N2O4S
InChI InChI=1S/C14H16N2O4S/c1-7-10(8(2)17)4-11(16-7)13-14(20-9(3)18)12(5-19-13)15-6-21/h4,12-14,16H,5H2,1-3H3/t12-,13-,14+/m1/s1
InChIKey IISWFUYWXXIWJJ-MCIONIFRSA-N
Literature Reference Author J.FUENTES,M.ANGULO,M.A.PRADERA
Literature Reference Citation J.ORG.CHEM.,67,2577(2002)
Literature Reference DOI 10.1021/jo0110303
Molecular Weight 308.352 g/mol
Solvent CDCl3
Source File Reference UWSI21463