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LXRLJUPLQGETMD-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

LXRLJUPLQGETMD-UHFFFAOYSA-N
SpectraBase Compound ID HZZMXdv7Bqo
InChI InChI=1S/C92H80O12/c1-57-25-37-65(38-26-57)89(97)101-85-55-86(102-90(98)66-39-27-58(2)28-40-66)78-51-77(85)69(45-33-61-17-9-5-10-18-61)73-49-74(82(94)53-81(73)93)71(47-35-63-21-13-7-14-22-63)79-52-80(88(104-92(100)68-43-31-60(4)32-44-68)56-87(79)103-91(99)67-41-29-59(3)30-42-67)72(48-36-64-23-15-8-16-24-64)76-50-75(83(95)54-84(76)96)70(78)46-34-62-19-11-6-12-20-62/h5-32,37-44,49-56,69-72,93-96H,33-36,45-48H2,1-4H3
InChIKey LXRLJUPLQGETMD-UHFFFAOYSA-N
Mol Weight 1377.6 g/mol
Molecular Formula C92H80O12
Exact Mass 1376.564978 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HhkWKXpdCL
Name LXRLJUPLQGETMD-UHFFFAOYSA-N
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C92H80O12
InChI InChI=1S/C92H80O12/c1-57-25-37-65(38-26-57)89(97)101-85-55-86(102-90(98)66-39-27-58(2)28-40-66)78-51-77(85)69(45-33-61-17-9-5-10-18-61)73-49-74(82(94)53-81(73)93)71(47-35-63-21-13-7-14-22-63)79-52-80(88(104-92(100)68-43-31-60(4)32-44-68)56-87(79)103-91(99)67-41-29-59(3)30-42-67)72(48-36-64-23-15-8-16-24-64)76-50-75(83(95)54-84(76)96)70(78)46-34-62-19-11-6-12-20-62/h5-32,37-44,49-56,69-72,93-96H,33-36,45-48H2,1-4H3
InChIKey LXRLJUPLQGETMD-UHFFFAOYSA-N
Literature Reference Author D.J.EISLER,R.J.PUDDEPHATT
Literature Reference Citation CAN.J.CHEM.,82,185(2004)
Literature Reference DOI 10.1139/v03-105
Molecular Weight 1377.640 g/mol
Solvent Unknown
Source File Reference UWVN27590