| SpectraBase Spectrum ID |
4qbgl4W6TC3 |
| Name |
3-(2-methyl-4-nitro-1H-imidazol-1-yl)propanoic acid |
| CAS Registry Number |
16935-04-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H9N3O4 |
| InChI |
InChI=1S/C7H9N3O4/c1-5-8-6(10(13)14)4-9(5)3-2-7(11)12/h4H,2-3H2,1H3,(H,11,12) |
| InChIKey |
QIJTUXYFQLHGJI-UHFFFAOYSA-N |
| Molecular Weight |
199.166 g/mol |
| SMILES |
OC(CC[n]1cc(nc1C)N(=O)=O)=O |
| SPLASH |
splash10-0002-0900000000-0367710a63c2da773a3d |
| Source of Spectrum |
J-55-3703-3 |
| Wiley ID |
1196468 |
