For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

MANNITOL-HEXABENZOATE

View entire compound with spectra: 1 NMR

MANNITOL-HEXABENZOATE
SpectraBase Compound ID bnv1XyqcR1
InChI InChI=1S/C48H38O12/c49-43(33-19-7-1-8-20-33)55-31-39(57-45(51)35-23-11-3-12-24-35)41(59-47(53)37-27-15-5-16-28-37)42(60-48(54)38-29-17-6-18-30-38)40(58-46(52)36-25-13-4-14-26-36)32-56-44(50)34-21-9-2-10-22-34/h1-30,39-42H,31-32H2/t39-,40-,41-,42+/m1/s1
InChIKey LDCRTWOPHMRXIF-MVJOSCLSSA-N
Mol Weight 806.8 g/mol
Molecular Formula C48H38O12
Exact Mass 806.236327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 58azK9tjFwz
Name MANNITOL-HEXABENZOATE
Compound Number 1548
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H38O12
InChI InChI=1S/C48H38O12/c49-43(33-19-7-1-8-20-33)55-31-39(57-45(51)35-23-11-3-12-24-35)41(59-47(53)37-27-15-5-16-28-37)42(60-48(54)38-29-17-6-18-30-38)40(58-46(52)36-25-13-4-14-26-36)32-56-44(50)34-21-9-2-10-22-34/h1-30,39-42H,31-32H2/t39-,40-,41-,42+/m1/s1
InChIKey LDCRTWOPHMRXIF-MVJOSCLSSA-N
Literature Reference Author W.ROBIEN
Literature Reference Citation W.ROBIEN,PRIVATE_COMMUNICATION
Molecular Weight 806.823 g/mol
Sample ID 3565
Solvent CDCl3