| SpectraBase Spectrum ID |
6VHqwXSBKhg |
| Name |
3-Butoxy-3-(toluene-4-sulfonylimino)-propionic acid ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
341.129694014 u |
| Formula |
C16H23NO5S |
| InChI |
InChI=1S/C16H23NO5S/c1-4-6-11-22-15(12-16(18)21-5-2)17-23(19,20)14-9-7-13(3)8-10-14/h7-10H,4-6,11-12H2,1-3H3/b17-15- |
| InChIKey |
MXZZCUNHAPUAEP-ICFOKQHNSA-N |
| Molecular Weight |
341.422 g/mol |
| SMILES |
C(\C(=N\S(C=1C=CC(=CC1)C)(=O)=O)OCCCC)C(=O)OCC |
