| SpectraBase Compound ID | 4ReOdM80rp |
|---|---|
| InChI | InChI=1S/C6H10O2/c1-4(5(2)7)6(3)8/h4H,1-3H3 |
| InChIKey | GSOHKPVFCOWKPU-UHFFFAOYSA-N |
| Mol Weight | 114.14 g/mol |
| Molecular Formula | C6H10O2 |
| Exact Mass | 114.06808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5NPagLeeMAn |
|---|---|
| Name | 2,4-PENTANDIONE, 3-METHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H10O2 |
| InChI | InChI=1S/C6H10O2/c1-4(5(2)7)6(3)8/h4H,1-3H3 |
| InChIKey | GSOHKPVFCOWKPU-UHFFFAOYSA-N |
| Molecular Weight | 114.0678 |
| SMILES | CC(C(C(C)=O)C)=O |
| SPLASH | splash10-0006-9000000000-32d548cd6555e5a165a3 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |