| SpectraBase Spectrum ID |
G9FFzt76z21 |
| Name |
4-(4-keto-4-methoxy-butyl)-1H-pyrrole-2-carboxylic acid ethyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H17NO4 |
| InChI |
InChI=1S/C12H17NO4/c1-3-17-12(15)10-7-9(8-13-10)5-4-6-11(14)16-2/h7-8,13H,3-6H2,1-2H3 |
| InChIKey |
MFSJVZGDBSJNSL-UHFFFAOYSA-N |
| Molecular Weight |
239.271 g/mol |
| SMILES |
[nH]1cc(cc1C(=O)OCC)CCCC(=O)OC |
| SPLASH |
splash10-0a4i-0900000000-a804788d9bffbc3f68a6 |
| Source of Spectrum |
E1-44-58-3 |
| Synonyms |
4-(4-methoxy-4-oxobutyl)-1H-pyrrole-2-carboxylic acid ethyl ester
ethyl 4-(4-methoxy-4-oxidanylidene-butyl)-1H-pyrrole-2-carboxylate
ethyl 4-(4-methoxy-4-oxo-butyl)-1H-pyrrole-2-carboxylate |
| Wiley ID |
1553234 |
