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2,5-O-[BENZENE-1,2-DIYL-BIS-(OXYETHYLENEOXYETHYL)]-3,4-DI-O-BENZOYL-1,6-DIDEOXY-1,6-BIS-(4,5-DIPHENYL-1,2,3-TRIAZOL-1-YL)-D-MANNITOL

View entire compound with spectra: 1 NMR

2,5-O-[BENZENE-1,2-DIYL-BIS-(OXYETHYLENEOXYETHYL)]-3,4-DI-O-BENZOYL-1,6-DIDEOXY-1,6-BIS-(4,5-DIPHENYL-1,2,3-TRIAZOL-1-YL)-D-MANNITOL
SpectraBase Compound ID 3gC7mHExeDL
InChI InChI=1S/C62H58N6O10/c69-61(49-29-15-5-16-30-49)77-59-53(43-67-57(47-25-11-3-12-26-47)55(63-65-67)45-21-7-1-8-22-45)75-41-37-71-35-39-73-51-33-19-20-34-52(51)74-40-36-72-38-42-76-54(60(59)78-62(70)50-31-17-6-18-32-50)44-68-58(48-27-13-4-14-28-48)56(64-66-68)46-23-9-2-10-24-46/h1-34,53-54,59-60H,35-44H2/t53-,54-,59-,60-/m1/s1
InChIKey IADRHQPBILXHBU-NMJCAHKOSA-N
Mol Weight 1047.2 g/mol
Molecular Formula C62H58N6O10
Exact Mass 1046.421442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IVVozmW4Kbq
Name 2,5-O-[BENZENE-1,2-DIYL-BIS-(OXYETHYLENEOXYETHYL)]-3,4-DI-O-BENZOYL-1,6-DIDEOXY-1,6-BIS-(4,5-DIPHENYL-1,2,3-TRIAZOL-1-YL)-D-MANNITOL
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C62H58N6O10
InChI InChI=1S/C62H58N6O10/c69-61(49-29-15-5-16-30-49)77-59-53(43-67-57(47-25-11-3-12-26-47)55(63-65-67)45-21-7-1-8-22-45)75-41-37-71-35-39-73-51-33-19-20-34-52(51)74-40-36-72-38-42-76-54(60(59)78-62(70)50-31-17-6-18-32-50)44-68-58(48-27-13-4-14-28-48)56(64-66-68)46-23-9-2-10-24-46/h1-34,53-54,59-60H,35-44H2/t53-,54-,59-,60-/m1/s1
InChIKey IADRHQPBILXHBU-NMJCAHKOSA-N
Literature Reference Author M.NAZHAOUI,J.P.JOLY,S.KITANE,M.BERRADA
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3845(1998)
Literature Reference DOI 10.1039/a804873h
Molecular Weight 1047.177 g/mol
Solvent CDCl3