| SpectraBase Compound ID | 19vqHRPNq29 |
|---|---|
| InChI | InChI=1S/C24H40NO4/c1-10-11-21(26-6)15-22(27-7)16-23(28-8)17-24(29-9)19(3)14-18(2)12-13-20(4)25-5/h5,10,13-14,21-24H,1,3,11-12,15-17H2,2,4,6-9H3/q+1/b18-14-,20-13+/t21-,22-,23-,24-/m0/s1 |
| InChIKey | UJFGJLPRNCOJIK-HMBLHOGSSA-N |
| Mol Weight | 406.6 g/mol |
| Molecular Formula | C24H40NO4 |
| Exact Mass | 406.295734 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ad28q7VVLCc |
|---|---|
| Name | MIRABILENE-E-ISONITRILE |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H40NO4 |
| InChI | InChI=1S/C24H40NO4/c1-10-11-21(26-6)15-22(27-7)16-23(28-8)17-24(29-9)19(3)14-18(2)12-13-20(4)25-5/h5,10,13-14,21-24H,1,3,11-12,15-17H2,2,4,6-9H3/q+1/b18-14-,20-13+/t21-,22-,23-,24-/m0/s1 |
| InChIKey | UJFGJLPRNCOJIK-HMBLHOGSSA-N |
| Literature Reference Author | S.CARMELI,R.E.MOORE,G.M.L.PATTERSON,Y.MORI,M.SUZUKI |
| Literature Reference Citation | J.ORG.CHEM.,55,4431(1990) |
| Literature Reference DOI | 10.1021/jo00301a041 |
| Molecular Weight | 406.586 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWCS14624 |