| SpectraBase Spectrum ID |
8DIFst4gCDs |
| Name |
4-Amino-1-(3-chloro-2-oxopropyl)-5-nitroimidazole |
| Alternate Name(s) |
1-(4-amino-5-nitro-1-imidazolyl)-3-chloro-2-propanone
1-(4-amino-5-nitroimidazol-1-yl)-3-chloropropan-2-one
1-(4-amino-5-nitro-imidazol-1-yl)-3-chloro-propan-2-one
1-(4-azanyl-5-nitro-imidazol-1-yl)-3-chloranyl-propan-2-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H7ClN4O3 |
| InChI |
InChI=1S/C6H7ClN4O3/c7-1-4(12)2-10-3-9-5(8)6(10)11(13)14/h3H,1-2,8H2 |
| InChIKey |
XCXNWTJGFLQRDA-UHFFFAOYSA-N |
| Molecular Weight |
218.600 g/mol |
| SMILES |
Nc1nc[n](c1N(=O)=O)CC(=O)CCl |
| SPLASH |
splash10-014i-8090000000-704bbe9926c10406e297 |
| Source of Spectrum |
Y-47-1054-30 |
| Wiley ID |
1667379 |
