| SpectraBase Spectrum ID |
E4PG2FZGIc6 |
| Name |
1H-Pyrrole-3-acetic acid, 2-(ethoxycarbonyl)-4,5-dimethyl-, ethyl ester |
| Alternate Name(s) |
ethyl 3-(2-ethoxy-2-oxoethyl)-4,5-dimethyl-1H-pyrrole-2-carboxylate
Ethyl 3-(ethoxycarbonylmethyl)-4,5-dimethylpyrrole-2-carboxylate |
| CAS Registry Number |
54278-18-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H19NO4 |
| InChI |
InChI=1S/C13H19NO4/c1-5-17-11(15)7-10-8(3)9(4)14-12(10)13(16)18-6-2/h14H,5-7H2,1-4H3 |
| InChIKey |
YTGRJWJELYGVEI-UHFFFAOYSA-N |
| Molecular Weight |
253.298 g/mol |
| SMILES |
[nH]1c(c(c(c1C(=O)OCC)CC(=O)OCC)C)C |
| SPLASH |
splash10-0f89-0890000000-2c7085cb3887fdbe7822 |
| Source of Spectrum |
F-39-1852-0 |
| Wiley ID |
1256716 |
