| SpectraBase Compound ID | 70X6vmGKLxm |
|---|---|
| InChI | InChI=1S/C7H14O/c1-4-7(8)5-6(2)3/h6H,4-5H2,1-3H3 |
| InChIKey | DXVYLFHTJZWTRF-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5N2HPxX2NM |
|---|---|
| Name | 5-METHYL-3-HEXANONE |
| Source of Sample | Pfaltz & Bauer, Inc., Waterbury, Connecticut |
| Boiling Point | 132-133C/740mm |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-4-7(8)5-6(2)3/h6H,4-5H2,1-3H3 |
| InChIKey | DXVYLFHTJZWTRF-UHFFFAOYSA-N |
| Molecular Weight | 114.19 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | 3-HEXANONE, 5-METHYL-, |