| SpectraBase Spectrum ID |
Fm35Wv8LBNg |
| Name |
Methyl 8-oxo-8-[1'-(phenylsulfonyl)-1H-pyrrol-3'-yl]-octanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.129694014 u |
| Formula |
C19H23NO5S |
| InChI |
InChI=1S/C19H23NO5S/c1-25-19(22)12-8-3-2-7-11-18(21)16-13-14-20(15-16)26(23,24)17-9-5-4-6-10-17/h4-6,9-10,13-15H,2-3,7-8,11-12H2,1H3 |
| InChIKey |
AXPLZYQQCDOOOE-UHFFFAOYSA-N |
| Molecular Weight |
377.455 g/mol |
| SMILES |
C=1N(S(=O)(=O)C2=CC=CC=C2)C=CC1C(=O)CCCCCCC(=O)OC |
![Methyl 8-oxo-8-[1'-(phenylsulfonyl)-1H-pyrrol-3'-yl]-octanoate](/api/spectrum/Fm35Wv8LBNg/structure.png?h=300&w=458 "Methyl 8-oxo-8-[1'-(phenylsulfonyl)-1H-pyrrol-3'-yl]-octanoate")
