| SpectraBase Compound ID | Hg1SSaLdXCI |
|---|---|
| InChI | InChI=1S/C8H16O/c1-4-6-7(3)8(9)5-2/h7H,4-6H2,1-3H3 |
| InChIKey | MVLRILUUXLBENA-UHFFFAOYSA-N |
| Mol Weight | 128.21 g/mol |
| Molecular Formula | C8H16O |
| Exact Mass | 128.120115 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GqqVOtYFE4U |
|---|---|
| Name | 3-Heptanone, 4-methyl- |
| CAS Registry Number | 6137-11-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H16O |
| InChI | InChI=1S/C8H16O/c1-4-6-7(3)8(9)5-2/h7H,4-6H2,1-3H3 |
| InChIKey | MVLRILUUXLBENA-UHFFFAOYSA-N |
| Molecular Weight | 128.215 g/mol |
| SMILES | C(C(CC)=O)(CCC)C |
| SPLASH | splash10-0a4i-9000000000-69533d0b7ebde185a742 |
| Source of Spectrum | LQ-1992-3481-0 |
| Synonyms | 4-Methyl-3-heptanone 4-Methylheptan-3-one |
| Wiley ID | 1131604 |