| SpectraBase Compound ID | 9r60NOVKOhC |
|---|---|
| InChI | InChI=1S/C7H12O/c1-5-7(3,4)6(2)8/h5H,1H2,2-4H3 |
| InChIKey | ZMCKXDZHFIPQJT-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 17X45MfYkox |
|---|---|
| Name | 3,3-Dimethyl-4-penten-2-one |
| CAS Registry Number | 4181-07-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-5-7(3,4)6(2)8/h5H,1H2,2-4H3 |
| InChIKey | ZMCKXDZHFIPQJT-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | C(C(=O)C)(C=C)(C)C |
| SPLASH | splash10-0006-9000000000-03e2b0e000f5846ece0a |
| Source of Spectrum | J-51-1400-4 |
| Synonyms | 3,3-Dimethylpent-4-en-2-one |
| Wiley ID | 1123488 |