| SpectraBase Compound ID | Bmr2WfJaV9E |
|---|---|
| InChI | InChI=1S/C16H26N4O3S/c1-11(2)14(19-20-17)7-6-12(3)8-9-24-10-15(16(22)23-5)18-13(4)21/h8,14-15H,1,6-7,9-10H2,2-5H3,(H,18,21)/b12-8+/t14?,15-/m0/s1 |
| InChIKey | DTEPBCFEZUBSPP-PMKHYWSKSA-N |
| Mol Weight | 354.47 g/mol |
| Molecular Formula | C16H26N4O3S |
| Exact Mass | 354.172562 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AIZ8ZBuSLiS |
|---|---|
| Name | ISOMERIC-PRODUCT |
| Compound Number | 9B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H26N4O3S |
| InChI | InChI=1S/C16H26N4O3S/c1-11(2)14(19-20-17)7-6-12(3)8-9-24-10-15(16(22)23-5)18-13(4)21/h8,14-15H,1,6-7,9-10H2,2-5H3,(H,18,21)/b12-8+/t14?,15-/m0/s1 |
| InChIKey | DTEPBCFEZUBSPP-PMKHYWSKSA-N |
| Literature Reference Author | T.A.KALE,M.D.DISTEFANO |
| Literature Reference Citation | ORG.LETTERS,5,609(2003) |
| Literature Reference DOI | 10.1021/ol026752a |
| Molecular Weight | 354.467 g/mol |
| Sample ID | 49470 |
| Solvent | CDCl3 |