Debug Info

object
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_id
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wviALrTD4D
spectrumID
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wviALrTD4D
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1
specType
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16777216
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analyticalTechnique
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31P NMR
analyticalTechniqueLongName
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31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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OCIMQQDVDVBZKM-UHFFFAOYSA-N
SpectraBase Compound ID 6gGbD4heKUj
InChI InChI=1S/C81H115O9P/c1-5-9-13-17-21-25-29-33-40-46-62-66-50-68-63(47-41-34-30-26-22-18-14-10-6-2)70-52-72-65(49-43-36-32-28-24-20-16-12-8-4)73-53-71-64(48-42-35-31-27-23-19-15-11-7-3)69-51-67(62)75-55-77(69)86-60-88-79(71)57-81(73)90-91(82,61-44-38-37-39-45-61)89-80(72)56-78(70)87-59-85-76(68)54-74(66)83-58-84-75/h37-39,44-45,50-57,62-65H,5-36,40-43,46-49,58-60H2,1-4H3
InChIKey OCIMQQDVDVBZKM-UHFFFAOYSA-N
Mol Weight 1263.8 g/mol
Molecular Formula C81H115O9P
Exact Mass 1262.827872 g/mol
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31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID wviALrTD4D
Name OCIMQQDVDVBZKM-UHFFFAOYSA-N
Compound Number MO
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C81H115O9P
InChI InChI=1S/C81H115O9P/c1-5-9-13-17-21-25-29-33-40-46-62-66-50-68-63(47-41-34-30-26-22-18-14-10-6-2)70-52-72-65(49-43-36-32-28-24-20-16-12-8-4)73-53-71-64(48-42-35-31-27-23-19-15-11-7-3)69-51-67(62)75-55-77(69)86-60-88-79(71)57-81(73)90-91(82,61-44-38-37-39-45-61)89-80(72)56-78(70)87-59-85-76(68)54-74(66)83-58-84-75/h37-39,44-45,50-57,62-65H,5-36,40-43,46-49,58-60H2,1-4H3
InChIKey OCIMQQDVDVBZKM-UHFFFAOYSA-N
Literature Reference Author M.SUMAN,M.FREDDI,C.MASSERA,F.UGOZZOLI,E.DALCANALE
Literature Reference Citation J.AM.CHEM.SOC.,125,12068(2003)
Literature Reference DOI 10.1021/ja0355271
Solvent CDCl3
Source File Reference UWLU50554
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