| SpectraBase Compound ID | Bi6KZxzNme3 |
|---|---|
| InChI | InChI=1S/C10H19NO3/c1-5-10(12)8(4)9(7(2)3)6-11(13)14/h7-9H,5-6H2,1-4H3 |
| InChIKey | CHOFLIPQSLHOLD-UHFFFAOYSA-N |
| Mol Weight | 201.27 g/mol |
| Molecular Formula | C10H19NO3 |
| Exact Mass | 201.136493 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5zumt0zz5Up |
|---|---|
| Name | 4,6-Dimethyl-5-(nitromethyl)-3-heptanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H19NO3 |
| InChI | InChI=1S/C10H19NO3/c1-5-10(12)8(4)9(7(2)3)6-11(13)14/h7-9H,5-6H2,1-4H3 |
| InChIKey | CHOFLIPQSLHOLD-UHFFFAOYSA-N |
| Molecular Weight | 201.266 g/mol |
| SMILES | CC(C(C(C(CC)=O)C)CN(=O)=O)C |
| SPLASH | splash10-0a4i-9100000000-30d1d35f1f5b355a07a7 |
| Synonyms | 4,6-Dimethyl-5-(nitromethyl)heptan-3-one |
| Wiley ID | 1477422 |