John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FjspgHTjYCf SpectraBase Spectrum ID=EaDL55uu8wz

(accessed ).
ISOHOPEAPHENOL
SpectraBase Compound ID FjspgHTjYCf
InChI InChI=1S/C56H42O12/c57-29-9-1-25(2-10-29)45-47-37(17-33(61)21-41(47)65)53-49-39(19-35(63)23-43(49)67-55(53)27-5-13-31(59)14-6-27)51(45)52-40-20-36(64)24-44-50(40)54(56(68-44)28-7-15-32(60)16-8-28)38-18-34(62)22-42(66)48(38)46(52)26-3-11-30(58)12-4-26/h1-24,45-46,51-66H/t45-,46-,51+,52+,53+,54+,55-,56-/m1/s1
InChIKey YQQUILZPDYJDQJ-DAZNBUADSA-N
Mol Weight 906.9 g/mol
Molecular Formula C56H42O12
Exact Mass 906.267627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EaDL55uu8wz
Name ISOHOPEAPHENOL
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H42O12
InChI InChI=1S/C56H42O12/c57-29-9-1-25(2-10-29)45-47-37(17-33(61)21-41(47)65)53-49-39(19-35(63)23-43(49)67-55(53)27-5-13-31(59)14-6-27)51(45)52-40-20-36(64)24-44-50(40)54(56(68-44)28-7-15-32(60)16-8-28)38-18-34(62)22-42(66)48(38)46(52)26-3-11-30(58)12-4-26/h1-24,45-46,51-66H/t45-,46-,51+,52+,53+,54+,55-,56-/m1/s1
InChIKey YQQUILZPDYJDQJ-DAZNBUADSA-N
Literature Reference Author J.ITO,M.NIWA,Y.OSHIMA
Literature Reference Citation HETEROCYCLES,45,1809(1997)
Literature Reference DOI 10.3987/COM-97-7870
Molecular Weight 906.942 g/mol
Solvent Unknown
Source File Reference UWCP8408
SpectraBase Batch ID J6MpQvSk0gk