| SpectraBase Compound ID | KB1X72E3l5A |
|---|---|
| InChI | InChI=1S/C10H17NO9S2.K.H2O/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10;;/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18);;1H2/q;+1;/p-1/b11-6+;;/t5-,7-,8+,9-,10+;;/m1../s1 |
| InChIKey | IUBVMJHASFBYGW-WBMBWNLZSA-M |
| Mol Weight | 415.47 g/mol |
| Molecular Formula | C10H18KNO10S2 |
| Exact Mass | 415.00092 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G8FPKu8KXGZ |
|---|---|
| Name | 1-thio-beta-D-glucopyranose, 1-(3-butenohydroximate), NO-(hydrogen sulfate), monopotassium salt, monohydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H18KNO10S2 |
| InChI | InChI=1S/C10H17NO9S2.K.H2O/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10;;/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18);;1H2/q;+1;/p-1/b11-6+;;/t5-,7-,8+,9-,10+;;/m1../s1 |
| InChIKey | IUBVMJHASFBYGW-WBMBWNLZSA-M |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 33610M |
| Solvent | D2O |