| SpectraBase Compound ID | 1Mum87nbPZ8 |
|---|---|
| InChI | InChI=1S/C11H21NO10S2/c1-11(2,17)3-6(12-22-24(18,19)20)23-10-9(16)8(15)7(14)5(4-13)21-10/h5,7-10,13-17H,3-4H2,1-2H3,(H,18,19,20)/b12-6+/t5-,7-,8+,9-,10+/m1/s1 |
| InChIKey | DYAQCRHEYVANDL-PGFQGKCASA-N |
| Mol Weight | 391.41 g/mol |
| Molecular Formula | C11H21NO10S2 |
| Exact Mass | 391.060688 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F1d4c1ayF0J |
|---|---|
| Name | 2-Hydroxy-2-methyl-propyl glucosinolate |
| CAS Registry Number | 28463-28-7 |
| Comments | potassium salt |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H21NO10S2 |
| InChI | InChI=1S/C11H21NO10S2/c1-11(2,17)3-6(12-22-24(18,19)20)23-10-9(16)8(15)7(14)5(4-13)21-10/h5,7-10,13-17H,3-4H2,1-2H3,(H,18,19,20)/b12-6+/t5-,7-,8+,9-,10+/m1/s1 |
| InChIKey | DYAQCRHEYVANDL-PGFQGKCASA-N |
| Literature Reference | O. Olsen, H. Sorensen, Phytochem. 18, 1547 (1979). |
| NMR Standard | Dioxane |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |