| SpectraBase Compound ID | 3WSWH6PrbIM |
|---|---|
| InChI | InChI=1S/C60H88N8O14/c1-58(2,3)45-36-46(59(4,5)6)38-48(37-45)68(57(73)82-60(7,8)9)20-15-11-10-12-16-47-43-67(66-65-47)21-19-61-53(69)40-62-54(70)41-63-55(71)42-64-56(72)44-34-49-39-50(35-44)79-31-27-75-23-25-77-29-33-81-52-18-14-13-17-51(52)80-32-28-76-24-22-74-26-30-78-49/h13-14,17-18,34-39,43H,10-12,15-16,19-33,40-42H2,1-9H3,(H,61,69)(H,62,70)(H,63,71)(H,64,72) |
| InChIKey | PYSDEBJAULCLPR-UHFFFAOYSA-N |
| Mol Weight | 1145.4 g/mol |
| Molecular Formula | C60H88N8O14 |
| Exact Mass | 1144.642 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8OdHDuc8oSH |
|---|---|
| Name | PYSDEBJAULCLPR-UHFFFAOYSA-N |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H88N8O14 |
| InChI | InChI=1S/C60H88N8O14/c1-58(2,3)45-36-46(59(4,5)6)38-48(37-45)68(57(73)82-60(7,8)9)20-15-11-10-12-16-47-43-67(66-65-47)21-19-61-53(69)40-62-54(70)41-63-55(71)42-64-56(72)44-34-49-39-50(35-44)79-31-27-75-23-25-77-29-33-81-52-18-14-13-17-51(52)80-32-28-76-24-22-74-26-30-78-49/h13-14,17-18,34-39,43H,10-12,15-16,19-33,40-42H2,1-9H3,(H,61,69)(H,62,70)(H,63,71)(H,64,72) |
| InChIKey | PYSDEBJAULCLPR-UHFFFAOYSA-N |
| Literature Reference Author | C.CLAVEL,K.FOURNEL-MAROTTE,F.COUTROT |
| Literature Reference Citation | MOLECULES,18,11553(2013) |
| Literature Reference DOI | 10.3390/molecules180911553 |
| Molecular Weight | 1145.404 g/mol |
| Solvent | CD2Cl2 |
| Source File Reference | UWIR9546 |