| SpectraBase Spectrum ID |
GdeayU2nq8v |
| Name |
1H-Imidazole-1-propanoic acid, 2-methyl-4-nitro-, ethyl ester |
| CAS Registry Number |
126664-27-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H13N3O4 |
| InChI |
InChI=1S/C9H13N3O4/c1-3-16-9(13)4-5-11-6-8(12(14)15)10-7(11)2/h6H,3-5H2,1-2H3 |
| InChIKey |
HRWQGIHOXGZPQE-UHFFFAOYSA-N |
| Molecular Weight |
227.220 g/mol |
| SMILES |
c1(nc(C)[n](c1)CCC(=O)OCC)N(=O)=O |
| SPLASH |
splash10-004i-0090000000-1916cb437dc3696e84c3 |
| Source of Spectrum |
J-55-3703-3 |
| Synonyms |
3-(2-methyl-4-nitro-1-imidazolyl)propanoic acid ethyl ester
ethyl 3-(2-methyl-4-nitroimidazol-1-yl)propanoate
ethyl 3-(2-methyl-4-nitro-imidazol-1-yl)propanoate |
| Wiley ID |
1228376 |
