| SpectraBase Compound ID | 6dbyP4ZvlVQ |
|---|---|
| InChI | InChI=1S/C5H8O2/c1-4(6)3-5(2)7/h3H2,1-2H3 |
| InChIKey | YRKCREAYFQTBPV-UHFFFAOYSA-N |
| Mol Weight | 100.12 g/mol |
| Molecular Formula | C5H8O2 |
| Exact Mass | 100.052429 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JrZC2A8klwz |
|---|---|
| Name | ACETYLACETONE |
| CAS Registry Number | 123-54-6 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C5H8O2 |
| InChI | InChI=1S/C5H8O2/c1-4(6)3-5(2)7/h3H2,1-2H3 |
| InChIKey | YRKCREAYFQTBPV-UHFFFAOYSA-N |
| Literature Reference Author | S.SELTZER |
| Literature Reference Citation | J.ORG.CHEM.,46,2643(1981) |
| Literature Reference DOI | 10.1021/jo00326a007 |
| Molecular Weight | 100.117 g/mol |
| Solvent | H2O |
| Source File Reference | UNIW20144 |