| SpectraBase Compound ID | ATcLOBcmBCr |
|---|---|
| InChI | InChI=1S/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3 |
| InChIKey | UIHCLUNTQKBZGK-UHFFFAOYSA-N |
| Mol Weight | 100.16 g/mol |
| Molecular Formula | C6H12O |
| Exact Mass | 100.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AKUzbfiXmaa |
|---|---|
| Name | 3-Methyl-2-pentanone |
| Comments | MONAID: JP006450 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H12O |
| InChI | InChI=1S/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3 |
| InChIKey | UIHCLUNTQKBZGK-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 100.161 g/mol |
| SMILES | CCC(C)C(C)=O |
| SPLASH | splash10-0006-9000000000-0d80e9cdf8314ad39c69 |
| Source of Spectrum | SRH-2022-6450-0 |
| Wiley ID | 1828280 |