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QXBWEXNGJDMLLR-FOVOTZSJSA-N
SpectraBase Compound ID H6L4OeGb3lX
InChI InChI=1S/C84H90O14/c1-9-29-65(30-10-1)55-87-63-75-77(91-57-67-33-13-3-14-34-67)79(93-59-69-37-17-5-18-38-69)81(95-61-71-41-21-7-22-42-71)83(97-75)89-51-27-25-49-85-53-73-45-47-74(48-46-73)54-86-50-26-28-52-90-84-82(96-62-72-43-23-8-24-44-72)80(94-60-70-39-19-6-20-40-70)78(92-58-68-35-15-4-16-36-68)76(98-84)64-88-56-66-31-11-2-12-32-66/h1-48,75-84H,49-64H2/b27-25+,28-26+/t75-,76-,77+,78+,79+,80+,81-,82-,83-,84-/m0/s1
InChIKey QXBWEXNGJDMLLR-FOVOTZSJSA-N
Mol Weight 1323.6 g/mol
Molecular Formula C84H90O14
Exact Mass 1322.633058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2AgvqHIl1gL
Name QXBWEXNGJDMLLR-FOVOTZSJSA-N
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C84H90O14
InChI InChI=1S/C84H90O14/c1-9-29-65(30-10-1)55-87-63-75-77(91-57-67-33-13-3-14-34-67)79(93-59-69-37-17-5-18-38-69)81(95-61-71-41-21-7-22-42-71)83(97-75)89-51-27-25-49-85-53-73-45-47-74(48-46-73)54-86-50-26-28-52-90-84-82(96-62-72-43-23-8-24-44-72)80(94-60-70-39-19-6-20-40-70)78(92-58-68-35-15-4-16-36-68)76(98-84)64-88-56-66-31-11-2-12-32-66/h1-48,75-84H,49-64H2/b27-25+,28-26+/t75-,76-,77+,78+,79+,80+,81-,82-,83-,84-/m0/s1
InChIKey QXBWEXNGJDMLLR-FOVOTZSJSA-N
Literature Reference Author B.LIU,S.K.DAS,R.ROY
Literature Reference Citation ORG.LETTERS,4,2723(2002)
Literature Reference DOI 10.1021/ol026235s
Molecular Weight 1323.630 g/mol
Sample ID 37472
Solvent CDCl3