SpectraBase Compound ID | KjBGoNUUeJf |
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InChI | InChI=1S/C69H128O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25-30,66H,4-24,31-65H2,1-3H3/b28-25-,29-26-,30-27- |
InChIKey | XDSPGKDYYRNYJI-IUPFWZBJSA-N |
Mol Weight | 1053.8 g/mol |
Molecular Formula | C69H128O6 |
Exact Mass | 1052.971092 g/mol |
SpectraBase Spectrum ID | KJQfftZrEry |
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Name | (Z)-tri-13-docosenoin |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C69H128O6 |
InChI | InChI=1S/C69H128O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25-30,66H,4-24,31-65H2,1-3H3/b28-25-,29-26-,30-27- |
InChIKey | XDSPGKDYYRNYJI-IUPFWZBJSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 61624M |
Solvent | CDCl3 |