| SpectraBase Compound ID | KClms6SMC3Y |
|---|---|
| InChI | InChI=1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3 |
| InChIKey | PFCHFHIRKBAQGU-UHFFFAOYSA-N |
| Mol Weight | 100.16 g/mol |
| Molecular Formula | C6H12O |
| Exact Mass | 100.088815 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 20NOPb0gcwa |
|---|---|
| Name | 3-HEXANONE |
| CAS Registry Number | 589-38-8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H12O |
| InChI | InChI=1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3 |
| InChIKey | PFCHFHIRKBAQGU-UHFFFAOYSA-N |
| Literature Reference Author | C.DELSETH,J.P.KINTZINGER |
| Literature Reference Citation | HELV.CHIM.ACTA,59,466(1976) |
| Literature Reference DOI | 10.1002/hlca.19760590213 |
| Solvent | Unknown |
| Source File Reference | UNIO62 |