| SpectraBase Spectrum ID |
1KAkaSM9e0u |
| Name |
5-Amino-1-(3-chloro-2-hydroxypropyl)-4-nitroimidazole |
| Alternate Name(s) |
1-(5-amino-4-nitro-1-imidazolyl)-3-chloro-2-propanol
1-(5-amino-4-nitroimidazol-1-yl)-3-chloropropan-2-ol
1-(5-azanyl-4-nitro-imidazol-1-yl)-3-chloranyl-propan-2-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H9ClN4O3 |
| InChI |
InChI=1S/C6H9ClN4O3/c7-1-4(12)2-10-3-9-6(5(10)8)11(13)14/h3-4,12H,1-2,8H2 |
| InChIKey |
KILYPOHEHCGWTB-UHFFFAOYSA-N |
| Molecular Weight |
220.616 g/mol |
| SMILES |
Nc1[n](CC(O)CCl)cnc1N(=O)=O |
| SPLASH |
splash10-00di-9050000000-5b28538287d169c584c6 |
| Source of Spectrum |
Y-47-1053-26 |
| Wiley ID |
1667383 |
