| SpectraBase Compound ID | 9c8Agffb6OM |
|---|---|
| InChI | InChI=1S/C8H12O/c1-4-5-8(9)6-7(2)3/h4-6H,1-3H3/b5-4+ |
| InChIKey | NDIQNZBBNBMLMR-SNAWJCMRSA-N |
| Mol Weight | 124.18 g/mol |
| Molecular Formula | C8H12O |
| Exact Mass | 124.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 449GujALicS |
|---|---|
| Name | 2-METHYL-2,5-HEPTADIEN-4-ONE |
| Source of Sample | R. Hollenstein, W. Von Philipsborn Helv. Chim. Acta 55, 2030(1972) |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O |
| InChI | InChI=1S/C8H12O/c1-4-5-8(9)6-7(2)3/h4-6H,1-3H3/b5-4+ |
| InChIKey | NDIQNZBBNBMLMR-SNAWJCMRSA-N |
| Molecular Weight | 124.18 |
| Solvent | Chloroform-d; Reference=TMS; Temperature=305 K Spectrometer= Varian XL-100 |