| SpectraBase Spectrum ID |
KCDZSbpp8Iy |
| Name |
L-Glutamic acid dibenzyl ester toluene-4-sulfonate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
499.166473445 u |
| Formula |
C26H29NO7S |
| InChI |
InChI=1S/C19H21NO4.C7H8O3S/c20-17(19(22)24-14-16-9-5-2-6-10-16)11-12-18(21)23-13-15-7-3-1-4-8-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-10,17H,11-14,20H2;2-5H,1H3,(H,8,9,10)/t17-;/m0./s1 |
| InChIKey |
HVZUAIVKRYGQRM-LMOVPXPDSA-N |
| SMILES |
c1c(ccc(c1)C)S(=O)(=O)[O-].[NH3+][C@@](CCC(OCc1ccccc1)=O)(C(OCc1ccccc1)=O)[H] |
