| SpectraBase Spectrum ID |
14kxo9embfD |
| Name |
1H-Imidazole-1-propanenitrile, 2-methyl-5-nitro- |
| CAS Registry Number |
14885-27-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H8N4O2 |
| InChI |
InChI=1S/C7H8N4O2/c1-6-9-5-7(11(12)13)10(6)4-2-3-8/h5H,2,4H2,1H3 |
| InChIKey |
CFYGIEZPHZKCDZ-UHFFFAOYSA-N |
| Molecular Weight |
180.167 g/mol |
| SMILES |
c1([n](c(C)nc1)CCC#N)N(=O)=O |
| SPLASH |
splash10-001i-0900000000-74183a153589237bd39b |
| Source of Spectrum |
J-55-3703-2 |
| Synonyms |
3-(2-methyl-5-nitro-1-imidazolyl)propanenitrile
3-(2-methyl-5-nitroimidazol-1-yl)propanenitrile
3-(2-methyl-5-nitro-imidazol-1-yl)propanenitrile |
| Wiley ID |
1175765 |
