| SpectraBase Compound ID | 9HmgbyBvjzK |
|---|---|
| InChI | InChI=1S/C59H60Cl4N2O25S2.2C6H15N/c1-33(66)25-26-39(67)86-48-46(65-53(68)40-41(54(69)70)43(61)45(63)44(62)42(40)60)57(85-38(32-84-91(74,75)76)47(48)90-92(77,78)79)88-50-49(81-29-34-17-7-2-8-18-34)52(87-55(71)37-23-13-5-14-24-37)58(89-51(50)56(72)82-30-35-19-9-3-10-20-35)80-28-16-6-15-27-64-59(73)83-31-36-21-11-4-12-22-36;2*1-4-7(5-2)6-3/h2-5,7-14,17-24,38,46-52,57-58H,6,15-16,25-32H2,1H3,(H,64,73)(H,65,68)(H,69,70)(H,74,75,76)(H,77,78,79);2*4-6H2,1-3H3/t38-,46-,47+,48-,49+,50+,51+,52-,57+,58-;;/m0../s1 |
| InChIKey | DALRHVCVZQOYHF-VSRYRPFYSA-N |
| Mol Weight | 1605.44 g/mol |
| Molecular Formula | C71H90Cl4N4O25S2 |
| Exact Mass | 1602.408968 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2HHWHIGZyRS |
|---|---|
| Name | #18-DI-TRIETHYLAMMONIUM-SALT;BENZYL-[N-BENZYLOXYCARBONYL-5-AMINOPENTYL-2-O-BENZOYL-3-O-BENZYL-4-O-(2-DEOXY-3-O-LEVULINOYL-4,6-DI-O-SULFO-2-TETRACHLOROPHTHALIMI |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C71H90Cl4N4O25S2 |
| InChI | InChI=1S/C59H60Cl4N2O25S2.2C6H15N/c1-33(66)25-26-39(67)86-48-46(65-53(68)40-41(54(69)70)43(61)45(63)44(62)42(40)60)57(85-38(32-84-91(74,75)76)47(48)90-92(77,78)79)88-50-49(81-29-34-17-7-2-8-18-34)52(87-55(71)37-23-13-5-14-24-37)58(89-51(50)56(72)82-30-35-19-9-3-10-20-35)80-28-16-6-15-27-64-59(73)83-31-36-21-11-4-12-22-36;2*1-4-7(5-2)6-3/h2-5,7-14,17-24,38,46-52,57-58H,6,15-16,25-32H2,1H3,(H,64,73)(H,65,68)(H,69,70)(H,74,75,76)(H,77,78,79);2*4-6H2,1-3H3/t38-,46-,47+,48-,49+,50+,51+,52-,57+,58-;;/m0../s1 |
| InChIKey | DALRHVCVZQOYHF-VSRYRPFYSA-N |
| Literature Reference Author | G.MACCHIONE,S.MAZA,M.M.KAYSER,J.L.DEPAZ,P.M.NIETO |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2014,3868(2014) |
| Literature Reference DOI | 10.1002/ejoc.201402222 |
| Molecular Weight | 1605.439 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU85325 |