| SpectraBase Compound ID | KQZZvcBYeD8 |
|---|---|
| InChI | InChI=1S/C7H14O/c1-5-7(3,4)6(2)8/h5H2,1-4H3 |
| InChIKey | QSHJLBQLQVSEFV-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IEzsww2xuf |
|---|---|
| Name | 3,3-Dimethylpentan-2-one |
| Alternate Name(s) | 3,3-Dimethyl-2-pentanone C2H5C(CH3)2COCH3 |
| CAS Registry Number | 20669-04-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-5-7(3,4)6(2)8/h5H2,1-4H3 |
| InChIKey | QSHJLBQLQVSEFV-UHFFFAOYSA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | CC(CC)(C)C(C)=O |
| SPLASH | splash10-0006-9000000000-ab2c845fd83e09a5e54d |
| Wiley ID | 1476916 |