| SpectraBase Compound ID | KtiabYuhzOa |
|---|---|
| InChI | InChI=1S/C6H10O2/c1-5(7)3-4-6(2)8/h3-4H2,1-2H3 |
| InChIKey | OJVAMHKKJGICOG-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 | 7kLly8s6h0n |
|---|---|
| Name | 2,5-Hexanedione |
| CAS Registry Number | 110-13-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H10O2 |
| InChI | InChI=1S/C6H10O2/c1-5(7)3-4-6(2)8/h3-4H2,1-2H3 |
| InChIKey | OJVAMHKKJGICOG-UHFFFAOYSA-N |
| Molecular Weight | 114.144 g/mol |
| SMILES | C(=O)(CCC(=O)C)C |
| SPLASH | splash10-0006-9000000000-61294e4683858feccd08 |
| Source of Spectrum | AA-0-397-4 |
| Synonyms | .alpha.,.beta.-Diacetylethane 1,2-Diacetylethane 2,5-Diketohexane 2,5-Dioxohexane 2,5-Hexadione 2,5-Hexandione Acetone, acetonyl- CH3COCH2CH2COCH3 Diacetonyl HDO Hexan-2,5-dion Hexane-2,5-dione Hexanedione-(2,5) AI3-02399 BRN 0506525 CCRIS 2919 EINECS 203-738-3 NSC 7621 |
| Wiley ID | 1124319 |