| SpectraBase Compound ID | HS9udhLsMF3 |
|---|---|
| InChI | InChI=1S/C27H36N4O9/c1-15(32)29-21-19(37-16(2)33)12-27(25(35)40-26(4,5)6)14-28-30-31(27)22(21)23-20(38-17(3)34)13-36-24(39-23)18-10-8-7-9-11-18/h7-11,19-24H,12-14H2,1-6H3,(H,29,32)/t19-,20+,21+,22?,23-,24+,27+/m1/s1 |
| InChIKey | IPKABDMBWOZLOE-JVQOZZMDSA-N |
| Mol Weight | 560.6 g/mol |
| Molecular Formula | C27H36N4O9 |
| Exact Mass | 560.248229 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4IiZbHdfiLQ |
|---|---|
| Name | IPKABDMBWOZLOE-JVQOZZMDSA-N |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36N4O9 |
| InChI | InChI=1S/C27H36N4O9/c1-15(32)29-21-19(37-16(2)33)12-27(25(35)40-26(4,5)6)14-28-30-31(27)22(21)23-20(38-17(3)34)13-36-24(39-23)18-10-8-7-9-11-18/h7-11,19-24H,12-14H2,1-6H3,(H,29,32)/t19-,20+,21+,22?,23-,24+,27+/m1/s1 |
| InChIKey | IPKABDMBWOZLOE-JVQOZZMDSA-N |
| Literature Reference Author | B.BERNET,A.R.C.B.MURTY,A.VASELLA |
| Literature Reference Citation | HELV.CHIM.ACTA,73,940(1990) |
| Literature Reference DOI | 10.1002/hlca.19900730422 |
| Molecular Weight | 560.604 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED15556 |