| SpectraBase Compound ID | IPIHYImShSB |
|---|---|
| InChI | InChI=1S/C8H16O/c1-5-6-8(3,4)7(2)9/h5-6H2,1-4H3 |
| InChIKey | LJZPWSZYYTUCDP-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 | LK7xMCXLc2 |
|---|---|
| Name | 2-Hexanone, 3,3-dimethyl- |
| CAS Registry Number | 26118-38-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H16O |
| InChI | InChI=1S/C8H16O/c1-5-6-8(3,4)7(2)9/h5-6H2,1-4H3 |
| InChIKey | LJZPWSZYYTUCDP-UHFFFAOYSA-N |
| Molecular Weight | 128.215 g/mol |
| SMILES | CC(C(CCC)(C)C)=O |
| SPLASH | splash10-0006-9000000000-5d12a73f2bdedcc52550 |
| Source of Spectrum | JX-2015-6-1840 |
| Synonyms | 3,3-Dimethyl-2-hexanone 3,3-Dimethylhexan-2-one |
| Wiley ID | 1728149 |