| SpectraBase Spectrum ID |
GjchyQWaMPa |
| Name |
N,o-Ditosyl-4-hydroxy-L-proline, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
453.091594426 u |
| Formula |
C20H23NO7S2 |
| InChI |
InChI=1S/C20H23NO7S2/c1-14-4-8-17(9-5-14)29(23,24)21-13-16(12-19(21)20(22)27-3)28-30(25,26)18-10-6-15(2)7-11-18/h4-11,16,19H,12-13H2,1-3H3/t16-,19+/m1/s1 |
| InChIKey |
ICILFGNGVHEIRZ-APWZRJJASA-N |
| Molecular Weight |
453.524 g/mol |
| SMILES |
C1N([C@@](C[C@]1(OS(=O)(=O)C1=CC=C(C)C=C1)[H])(C(OC)=O)[H])S(=O)(=O)C1=CC=C(C=C1)C |
