| SpectraBase Compound ID | 7FWdRMDKHOw |
|---|---|
| InChI | InChI=1S/C16H36N.C13H17NO3/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-3-9(2)12(13(16)17)14-8-10-6-4-5-7-11(10)15/h5-16H2,1-4H3;4-9,12,15H,3H2,1-2H3,(H,16,17)/q+1;/p-1/b;14-8+/t;9-,12+/m.1/s1 |
| InChIKey | GPPQDMINSGDCMJ-CVXCHTBESA-M |
| Mol Weight | 476.75 g/mol |
| Molecular Formula | C29H52N2O3 |
| Exact Mass | 476.397794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J74eg8XaK7E |
|---|---|
| Name | SAL-L-ILE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H52N2O3 |
| InChI | InChI=1S/C16H36N.C13H17NO3/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-3-9(2)12(13(16)17)14-8-10-6-4-5-7-11(10)15/h5-16H2,1-4H3;4-9,12,15H,3H2,1-2H3,(H,16,17)/q+1;/p-1/b;14-8+/t;9-,12+/m.1/s1 |
| InChIKey | GPPQDMINSGDCMJ-CVXCHTBESA-M |
| Literature Reference Author | P.OSSOWICZ,E.JANUS,G.SCHROEDER,Z.ROZWADOWSKI |
| Literature Reference Citation | MOLECULES,18,4986(2013) |
| Literature Reference DOI | 10.3390/molecules18054986 |
| Molecular Weight | 476.743 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWBT9369 |