| SpectraBase Compound ID | 6LzYfoPMCxH |
|---|---|
| InChI | InChI=1S/C11H15N2S.C9H12O3S/c1-13-14(9-5-8-12)10-11-6-3-2-4-7-11;1-6-4-7(2)9(8(3)5-6)13(10,11)12/h2-4,6-7,13H,5,9-10H2,1H3;4-5H,1-3H3,(H,10,11,12)/q+1;/p-1 |
| InChIKey | UMLMCTOXRCKFQE-UHFFFAOYSA-M |
| Mol Weight | 406.56 g/mol |
| Molecular Formula | C20H26N2O3S2 |
| Exact Mass | 406.138485 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C2LzKTUxDxR |
|---|---|
| Name | UMLMCTOXRCKFQE-UHFFFAOYSA-M |
| Compound Number | 3Q |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H26N2O3S2 |
| InChI | InChI=1S/C11H15N2S.C9H12O3S/c1-13-14(9-5-8-12)10-11-6-3-2-4-7-11;1-6-4-7(2)9(8(3)5-6)13(10,11)12/h2-4,6-7,13H,5,9-10H2,1H3;4-5H,1-3H3,(H,10,11,12)/q+1;/p-1 |
| InChIKey | UMLMCTOXRCKFQE-UHFFFAOYSA-M |
| Literature Reference Author | W.FRANEK,P.K.CLAUS |
| Literature Reference Citation | MH.CHEM.,121,539(1990) |
| Literature Reference DOI | 10.1007/BF00810863 |
| Molecular Weight | 406.558 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED9841 |