| SpectraBase Compound ID | DJCTZBPEajK |
|---|---|
| InChI | InChI=1S/C9H14O/c1-5-6-9(3,4)7-8(2)10/h1H,6-7H2,2-4H3 |
| InChIKey | PXIVGHUHGWWZJQ-UHFFFAOYSA-N |
| Mol Weight | 138.21 g/mol |
| Molecular Formula | C9H14O |
| Exact Mass | 138.104465 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EJ9x9NC1YAE |
|---|---|
| Name | 6-HEPTYN-2-ONE, 4,4-DIMETHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H14O |
| InChI | InChI=1S/C9H14O/c1-5-6-9(3,4)7-8(2)10/h1H,6-7H2,2-4H3 |
| InChIKey | PXIVGHUHGWWZJQ-UHFFFAOYSA-N |
| Molecular Weight | 138.1041 |
| SMILES | C#CCC(CC(C)=O)(C)C |
| SPLASH | splash10-0006-9000000000-b5053efc04c1f209341d |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |