| SpectraBase Compound ID | ExjkBauhFBK |
|---|---|
| InChI | InChI=1S/C48H88N8O22/c1-61-33-25(17-49)75-29(37(33)65-5)21-53-45(57)41-42(46(58)54-22-30-38(66-6)34(62-2)26(18-50)76-30)72-14-10-70-12-16-74-44(48(60)56-24-32-40(68-8)36(64-4)28(20-52)78-32)43(73-15-11-69-9-13-71-41)47(59)55-23-31-39(67-7)35(63-3)27(19-51)77-31/h25-44H,9-24,49-52H2,1-8H3,(H,53,57)(H,54,58)(H,55,59)(H,56,60) |
| InChIKey | XIEGTPCXPBGAAB-UHFFFAOYSA-N |
| Mol Weight | 1129.3 g/mol |
| Molecular Formula | C48H88N8O22 |
| Exact Mass | 1128.601316 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 58lzspF66FH |
|---|---|
| Name | TETRA-AMINE-#18 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H88N8O22 |
| InChI | InChI=1S/C48H88N8O22/c1-61-33-25(17-49)75-29(37(33)65-5)21-53-45(57)41-42(46(58)54-22-30-38(66-6)34(62-2)26(18-50)76-30)72-14-10-70-12-16-74-44(48(60)56-24-32-40(68-8)36(64-4)28(20-52)78-32)43(73-15-11-69-9-13-71-41)47(59)55-23-31-39(67-7)35(63-3)27(19-51)77-31/h25-44H,9-24,49-52H2,1-8H3,(H,53,57)(H,54,58)(H,55,59)(H,56,60) |
| InChIKey | XIEGTPCXPBGAAB-UHFFFAOYSA-N |
| Literature Reference Author | J.M.LEHN,P.G.POTVIN |
| Literature Reference Citation | CAN.J.CHEM.,66,195(1988) |
| Literature Reference DOI | 10.1139/v88-032 |
| Molecular Weight | 1129.267 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED5857 |