| SpectraBase Compound ID | 1q1Nyj0vNs9 |
|---|---|
| InChI | InChI=1S/C28H48N2O2/c1-17(29(6)7)22-18(31)14-26(5)21-11-10-20-24(2,3)23(30(8)9)19(32)15-28(20)16-27(21,28)13-12-25(22,26)4/h10-11,17-23,31-32H,12-16H2,1-9H3/t17?,18-,19-,20+,21+,22+,23+,25-,26+,27+,28-/m1/s1 |
| InChIKey | KQPMIGNYSJUHRD-UICNOTTRSA-N |
| Mol Weight | 444.7 g/mol |
| Molecular Formula | C28H48N2O2 |
| Exact Mass | 444.371579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7OZMjQnYu07 |
|---|---|
| Name | CACLONATAMINOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H48N2O2 |
| InChI | InChI=1S/C28H48N2O2/c1-17(29(6)7)22-18(31)14-26(5)21-11-10-20-24(2,3)23(30(8)9)19(32)15-28(20)16-27(21,28)13-12-25(22,26)4/h10-11,17-23,31-32H,12-16H2,1-9H3/t17?,18-,19-,20+,21+,22+,23+,25-,26+,27+,28-/m1/s1 |
| InChIKey | KQPMIGNYSJUHRD-UICNOTTRSA-N |
| Literature Reference Author | W.L.MATOCHKO,A.JAMES,C.W.LAM,D.J.KOZERA,A.ATA,R.M.GENGAN |
| Literature Reference Citation | J.NAT.PROD.,73,1858(2010) |
| Literature Reference DOI | 10.1021/np100494u |
| Molecular Weight | 444.701 g/mol |
| Sample ID | 37029 |
| Solvent | CDCl3 |