| SpectraBase Spectrum ID |
9YftNjej5Uo |
| Name |
(3S)-3-(Tosylamino)butyric acid cyclohexyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.150429459 u |
| Formula |
C17H25NO4S |
| InChI |
InChI=1S/C17H25NO4S/c1-13-8-10-16(11-9-13)23(20,21)18-14(2)12-17(19)22-15-6-4-3-5-7-15/h8-11,14-15,18H,3-7,12H2,1-2H3/t14-/m0/s1 |
| InChIKey |
YJIRCKFJFMFBCS-AWEZNQCLSA-N |
| Molecular Weight |
339.450 g/mol |
| SMILES |
[C@](NS(C1=CC=C(C=C1)C)(=O)=O)(CC(OC1CCCCC1)=O)(C)[H] |
