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1-(2-D-Benzoyl-3,5-di-o-toluyl-.beta.-D-ribofuranosyl)-5,6-dimethylbenzimidazole

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1-(2-D-Benzoyl-3,5-di-o-toluyl-.beta.-D-ribofuranosyl)-5,6-dimethylbenzimidazole
SpectraBase Compound ID D2CWnNzqjrP
InChI InChI=1S/C37H34N2O7/c1-22-12-8-10-16-27(22)36(41)43-20-31-32(45-37(42)28-17-11-9-13-23(28)2)33(46-35(40)26-14-6-5-7-15-26)34(44-31)39-21-38-29-18-24(3)25(4)19-30(29)39/h5-19,21,31-34H,20H2,1-4H3
InChIKey SBYAJTPJIJGBMU-UHFFFAOYSA-N
Mol Weight 618.7 g/mol
Molecular Formula C37H34N2O7
Exact Mass 618.236601 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID nsOiSyPTsp
Name 1-(2-D-Benzoyl-3,5-di-o-toluyl-.beta.-D-ribofuranosyl)-5,6-dimethylbenzimidazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 618.236601436 u
Formula C37H34N2O7
InChI InChI=1S/C37H34N2O7/c1-22-12-8-10-16-27(22)36(41)43-20-31-32(45-37(42)28-17-11-9-13-23(28)2)33(46-35(40)26-14-6-5-7-15-26)34(44-31)39-21-38-29-18-24(3)25(4)19-30(29)39/h5-19,21,31-34H,20H2,1-4H3
InChIKey SBYAJTPJIJGBMU-UHFFFAOYSA-N
Molecular Weight 618.686 g/mol
SMILES C12=C(C=C(C(=C2)C)C)N=CN1C1C(C(C(O1)COC(=O)C1=CC=CC=C1C)OC(=O)C1=CC=CC=C1C)OC(=O)C1=CC=CC=C1