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2-THIOXO-7-(2,3,5-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-PYRROLO-[2,1-F]-1,2,4-TRIAZINE
SpectraBase Compound ID BTowgSaoqoQ
InChI InChI=1S/C32H25N3O7S/c36-29(20-10-4-1-5-11-20)39-19-25-27(41-30(37)21-12-6-2-7-13-21)28(42-31(38)22-14-8-3-9-15-22)26(40-25)24-17-16-23-18-33-32(43)34-35(23)24/h1-18,25-28H,19H2,(H,34,43)/t25-,26+,27-,28+/m0/s1
InChIKey JQHJQAJABKPZJN-ZVBOOHQUSA-N
Mol Weight 595.6 g/mol
Molecular Formula C32H25N3O7S
Exact Mass 595.141321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5hJGk5VvDYN
Name 2-THIOXO-7-(2,3,5-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-PYRROLO-[2,1-F]-1,2,4-TRIAZINE
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H25N3O7S
InChI InChI=1S/C32H25N3O7S/c36-29(20-10-4-1-5-11-20)39-19-25-27(41-30(37)21-12-6-2-7-13-21)28(42-31(38)22-14-8-3-9-15-22)26(40-25)24-17-16-23-18-33-32(43)34-35(23)24/h1-18,25-28H,19H2,(H,34,43)/t25-,26+,27-,28+/m0/s1
InChIKey JQHJQAJABKPZJN-ZVBOOHQUSA-N
Literature Reference Author M.HAYASHI,A.ARAKI,I.MAEBA
Literature Reference Citation HETEROCYCLES,34,569(1992)
Literature Reference DOI 10.3987/COM-91-5946
Molecular Weight 595.626 g/mol
Solvent CDCl3
Source File Reference UWGE2869