| SpectraBase Spectrum ID |
CrlfvzRBcUq |
| Name |
1H-Pyrrole-3-butanoic acid, 5-[(1,1-dimethylethoxy)carbonyl]-2,4-dimethyl-, methyl ester |
| Alternate Name(s) |
t-Butyl ester
tert-Butyl 4-(4-methoxy-4-oxobutyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| CAS Registry Number |
99602-69-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H25NO4 |
| InChI |
InChI=1S/C16H25NO4/c1-10-12(8-7-9-13(18)20-6)11(2)17-14(10)15(19)21-16(3,4)5/h17H,7-9H2,1-6H3 |
| InChIKey |
KXNKCUVSKGSISN-UHFFFAOYSA-N |
| Molecular Weight |
295.379 g/mol |
| SMILES |
[nH]1c(c(c(c1C(OC(C)(C)C)=O)C)CCCC(=O)OC)C |
| SPLASH |
splash10-0udr-0890000000-444e8526156209b1935b |
| Source of Spectrum |
KC-1985-1705-0 |
| Wiley ID |
1298193 |
![1H-Pyrrole-3-butanoic acid, 5-[(1,1-dimethylethoxy)carbonyl]-2,4-dimethyl-, methyl ester](/api/spectrum/CrlfvzRBcUq/structure.png?h=300&w=458 "1H-Pyrrole-3-butanoic acid, 5-[(1,1-dimethylethoxy)carbonyl]-2,4-dimethyl-, methyl ester")
