| SpectraBase Spectrum ID |
6w1ycAoaPNP |
| Name |
1H-Pyrrole-3-propanoic acid, 5-(chloromethyl)-4-(2-methoxy-2-oxoethyl)-1-[(trifluoromethyl)sulfonyl]-, methyl ester |
| Alternate Name(s) |
1-Trifluoromethylsulphonyl-2-chloromethyl-3-methoxycarbonylmethyl-4-(2-methoxycarbonylethyl)pyrrole
Methyl 3-{5-(chloromethyl)-4-(2-methoxy-2-oxoethyl)-1-[(trifluoromethyl)sulfonyl]-1H-pyrrol-3-yl}propanoate |
| CAS Registry Number |
127879-98-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15ClF3NO6S |
| InChI |
InChI=1S/C13H15ClF3NO6S/c1-23-11(19)4-3-8-7-18(25(21,22)13(15,16)17)10(6-14)9(8)5-12(20)24-2/h7H,3-6H2,1-2H3 |
| InChIKey |
BYISPRLKFVMEJM-UHFFFAOYSA-N |
| Molecular Weight |
405.772 g/mol |
| SMILES |
c1([n](S(C(F)(F)F)(=O)=O)cc(c1CC(=O)OC)CCC(=O)OC)CCl |
| SPLASH |
splash10-022i-0089100000-a3ba8954c3341a24439b |
| Source of Spectrum |
KC-1989-1953-43 |
| Wiley ID |
1371643 |
![1H-Pyrrole-3-propanoic acid, 5-(chloromethyl)-4-(2-methoxy-2-oxoethyl)-1-[(trifluoromethyl)sulfonyl]-, methyl ester](/api/spectrum/6w1ycAoaPNP/structure.png?h=300&w=458 "1H-Pyrrole-3-propanoic acid, 5-(chloromethyl)-4-(2-methoxy-2-oxoethyl)-1-[(trifluoromethyl)sulfonyl]-, methyl ester")
