| SpectraBase Compound ID | Yo4pFlk3G1 |
|---|---|
| InChI | InChI=1S/C42H56N9O22P/c1-19-9-48(39(58)44-35(19)54)31-5-23(53)28(69-31)14-63-17-66-25-7-33(50-11-21(3)37(56)46-41(50)60)71-30(25)16-67-74(62,73-43)72-26-8-34(51-12-22(4)38(57)47-42(51)61)70-29(26)15-64-18-65-24-6-32(68-27(24)13-52)49-10-20(2)36(55)45-40(49)59/h9-12,23-34,52-53H,5-8,13-18,43H2,1-4H3,(H,44,54,58)(H,45,55,59)(H,46,56,60)(H,47,57,61)/t23-,24+,25-,26-,27-,28+,29+,30+,31+,32-,33+,34+,74?/m1/s1 |
| InChIKey | OWCCQMKSWRNVOE-HOXSPNFXSA-N |
| Mol Weight | 1069.9 g/mol |
| Molecular Formula | C42H56N9O22P |
| Exact Mass | 1069.327751 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6JH98Vs24mI |
|---|---|
| Name | OWCCQMKSWRNVOE-HOXSPNFXSA-N |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H56N9O22P |
| InChI | InChI=1S/C42H56N9O22P/c1-19-9-48(39(58)44-35(19)54)31-5-23(53)28(69-31)14-63-17-66-25-7-33(50-11-21(3)37(56)46-41(50)60)71-30(25)16-67-74(62,73-43)72-26-8-34(51-12-22(4)38(57)47-42(51)61)70-29(26)15-64-18-65-24-6-32(68-27(24)13-52)49-10-20(2)36(55)45-40(49)59/h9-12,23-34,52-53H,5-8,13-18,43H2,1-4H3,(H,44,54,58)(H,45,55,59)(H,46,56,60)(H,47,57,61)/t23-,24+,25-,26-,27-,28+,29+,30+,31+,32-,33+,34+,74?/m1/s1 |
| InChIKey | OWCCQMKSWRNVOE-HOXSPNFXSA-N |
| Literature Reference Author | G.H.VEENEMAN,G.A.VANDERMAREL,H.VANDENELST,J.H.VANBOOM |
| Literature Reference Citation | REC.TR.CH.P.-B.,109,449(1990) |
| Molecular Weight | 1069.927 g/mol |
| Solvent | Unknown |
| Source File Reference | UWTS2391 |