| SpectraBase Spectrum ID |
E5UMqNwONwW |
| Name |
1H-Pyrrole-3-propanoic acid, 5-(hydroxymethyl)-4-(2-methoxy-2-oxoethyl)-1-[(trifluoromethyl)sulfonyl]-, methyl ester |
| CAS Registry Number |
127879-95-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16F3NO7S |
| InChI |
InChI=1S/C13H16F3NO7S/c1-23-11(19)4-3-8-6-17(25(21,22)13(14,15)16)10(7-18)9(8)5-12(20)24-2/h6,18H,3-5,7H2,1-2H3 |
| InChIKey |
UGCFBTBHCUYRPZ-UHFFFAOYSA-N |
| Molecular Weight |
387.326 g/mol |
| SMILES |
OCc1[n](S(C(F)(F)F)(=O)=O)cc(CCC(=O)OC)c1CC(=O)OC |
| SPLASH |
splash10-0006-0912000000-3af63a2d83a1b97eeb08 |
| Source of Spectrum |
KC-1989-1953-40 |
| Synonyms |
2-Hydroxymethyl-4-(2-methoxycarbonylethyl)-3-methoxy-carbonylmethyl-1-trifluoromethylsulphonylpyrrole
Methyl 3-{5-(hydroxymethyl)-4-(2-methoxy-2-oxoethyl)-1-[(trifluoromethyl)sulfonyl]-1H-pyrrol-3-yl}propanoate |
| Wiley ID |
1363273 |
![1H-Pyrrole-3-propanoic acid, 5-(hydroxymethyl)-4-(2-methoxy-2-oxoethyl)-1-[(trifluoromethyl)sulfonyl]-, methyl ester](/api/spectrum/E5UMqNwONwW/structure.png?h=300&w=458 "1H-Pyrrole-3-propanoic acid, 5-(hydroxymethyl)-4-(2-methoxy-2-oxoethyl)-1-[(trifluoromethyl)sulfonyl]-, methyl ester")
