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No Name
SpectraBase Compound ID Hqa0r8TT1We
InChI InChI=1S/C40H37F5N2O14/c1-5-14-54-40(53)47-33-36(59-20(4)50)34(58-19(3)49)27(17-55-18(2)48)60-38(33)56-16-26(37(51)61-35-31(44)29(42)28(41)30(43)32(35)45)46-39(52)57-15-25-23-12-8-6-10-21(23)22-11-7-9-13-24(22)25/h5-13,25-27,33-34,36,38H,1,14-17H2,2-4H3,(H,46,52)(H,47,53)/t26-,27+,33+,34+,36+,38+/m1/s1
InChIKey RQJFGRWFDFRFDU-HYKMQVHNSA-N
Mol Weight 864.7 g/mol
Molecular Formula C40H37F5N2O14
Exact Mass 864.216495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eqc8H8sZLTM
Compound Number 9
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C40H37F5N2O14/c1-5-14-54-40(53)47-33-36(59-20(4)50)34(58-19(3)49)27(17-55-18(2)48)60-38(33)56-16-26(37(51)61-35-31(44)29(42)28(41)30(43)32(35)45)46-39(52)57-15-25-23-12-8-6-10-21(23)22-11-7-9-13-24(22)25/h5-13,25-27,33-34,36,38H,1,14-17H2,2-4H3,(H,46,52)(H,47,53)/t26-,27+,33+,34+,36+,38+/m1/s1
InChIKey RQJFGRWFDFRFDU-HYKMQVHNSA-N
Literature Reference A.VARGAS-BERENGUEL,M.MELDAL,H.PAULSEN,K.BOCK J.CHEM.SOC.PERKIN-1,2615(1994)
Solvent Chloroform-d