| SpectraBase Spectrum ID |
D9vk3iin6F3 |
| Name |
(2S)-2-[(4-Methylphenyl)sulfonyloxymethyl]-5-oxo-1-pyrrolidinecarboxylic acid tert-butyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.124608633 u |
| Formula |
C17H23NO6S |
| InChI |
InChI=1S/C17H23NO6S/c1-12-5-8-14(9-6-12)25(21,22)23-11-13-7-10-15(19)18(13)16(20)24-17(2,3)4/h5-6,8-9,13H,7,10-11H2,1-4H3/t13-/m0/s1 |
| InChIKey |
XNWSBCQIYNTDBK-ZDUSSCGKSA-N |
| Molecular Weight |
369.432 g/mol |
| SMILES |
C(N1C(CC[C@]1(COS(C1=CC=C(C=C1)C)(=O)=O)[H])=O)(OC(C)(C)C)=O |
![(2S)-2-[(4-methylphenyl)sulfonyloxymethyl]-5-oxo-1-pyrrolidinecarboxylic acid tert-butyl ester](/api/spectrum/D9vk3iin6F3/structure.png?h=300&w=458 "(2S)-2-[(4-methylphenyl)sulfonyloxymethyl]-5-oxo-1-pyrrolidinecarboxylic acid tert-butyl ester")
