| SpectraBase Spectrum ID |
HAMjwipt8AH |
| Name |
Methyl 2- (S)-[(p-methylphenyl)sulfonylamino]-4-(phenylseleno)butanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
427.035651330 u |
| Formula |
C18H21NO4SSe |
| InChI |
InChI=1S/C18H21NO4SSe/c1-14-8-10-15(11-9-14)24(21,22)19-17(18(20)23-2)12-13-25-16-6-4-3-5-7-16/h3-11,17,19H,12-13H2,1-2H3/t17-/m0/s1 |
| InChIKey |
ITJSWHQUOFTJEE-KRWDZBQOSA-N |
| Molecular Weight |
426.401 g/mol |
| SMILES |
[C@](NS(C=1C=CC(=CC1)C)(=O)=O)(C(=O)OC)(CC[Se]C=1C=CC=CC1)[H] |
![Methyl 2- (S)-[(p-methylphenyl)sulfonylamino]-4-(phenylseleno)butanoate](/api/spectrum/HAMjwipt8AH/structure.png?h=300&w=458 "Methyl 2- (S)-[(p-methylphenyl)sulfonylamino]-4-(phenylseleno)butanoate")
