| SpectraBase Compound ID | 7pDsUHmOFfx |
|---|---|
| InChI | InChI=1S/C66H78N6O18S6/c1-61(2,3)85-55(79)37-19-31-25-44(74)68-50-39(57(81)87-63(7,8)9)21-33(93-50)27-46(76)70-52-41(59(83)89-65(13,14)15)23-35(95-52)29-48(78)72-54-42(60(84)90-66(16,17)18)24-36(96-54)30-47(77)71-53-40(58(82)88-64(10,11)12)22-34(94-53)28-45(75)69-51-38(56(80)86-62(4,5)6)20-32(92-51)26-43(73)67-49(37)91-31/h19-24H,25-30H2,1-18H3,(H,67,73)(H,68,74)(H,69,75)(H,70,76)(H,71,77)(H,72,78) |
| InChIKey | VZNCJGPJQMXMKI-UHFFFAOYSA-N |
| Mol Weight | 1435.7 g/mol |
| Molecular Formula | C66H78N6O18S6 |
| Exact Mass | 1434.369687 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DSaWM9uiLxh |
|---|---|
| Name | VZNCJGPJQMXMKI-UHFFFAOYSA-N |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C66H78N6O18S6 |
| InChI | InChI=1S/C66H78N6O18S6/c1-61(2,3)85-55(79)37-19-31-25-44(74)68-50-39(57(81)87-63(7,8)9)21-33(93-50)27-46(76)70-52-41(59(83)89-65(13,14)15)23-35(95-52)29-48(78)72-54-42(60(84)90-66(16,17)18)24-36(96-54)30-47(77)71-53-40(58(82)88-64(10,11)12)22-34(94-53)28-45(75)69-51-38(56(80)86-62(4,5)6)20-32(92-51)26-43(73)67-49(37)91-31/h19-24H,25-30H2,1-18H3,(H,67,73)(H,68,74)(H,69,75)(H,70,76)(H,71,77)(H,72,78) |
| InChIKey | VZNCJGPJQMXMKI-UHFFFAOYSA-N |
| Literature Reference Author | H.OEZBEK,D.LENTZ,H.U.REISSIG |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2010,6319(2010) |
| Literature Reference DOI | 10.1002/ejoc.201001066 |
| Molecular Weight | 1435.735 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU85743 |