| SpectraBase Compound ID | BYJrgpJedsX |
|---|---|
| InChI | InChI=1S/C5H8O/c1-3-4-5(2)6/h3-4H,1-2H3/b4-3+ |
| InChIKey | LABTWGUMFABVFG-ONEGZZNKSA-N |
| Mol Weight | 84.12 g/mol |
| Molecular Formula | C5H8O |
| Exact Mass | 84.057515 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HuAOeGElOGi |
|---|---|
| Name | METHYL-2-BUTENYL-KETONE |
| Compound Number | 5B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C5H8O |
| InChI | InChI=1S/C5H8O/c1-3-4-5(2)6/h3-4H,1-2H3/b4-3+ |
| InChIKey | LABTWGUMFABVFG-ONEGZZNKSA-N |
| Literature Reference Author | J.C.ZHUO |
| Literature Reference Citation | MOLECULES,4,320(1999) |
| Literature Reference DOI | 10.3390/41100320 |
| Solvent | CH3CN |
| Source File Reference | UWSI20130 |