| SpectraBase Compound ID | KdVVRSxj9tx |
|---|---|
| InChI | InChI=1S/C9H16O/c1-7-4-8(10)6-9(2,3)5-7/h7H,4-6H2,1-3H3 |
| InChIKey | POSWICCRDBKBMH-UHFFFAOYSA-N |
| Mol Weight | 140.23 g/mol |
| Molecular Formula | C9H16O |
| Exact Mass | 140.120115 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8n2MRP7vCm0 |
|---|---|
| Name | 3,3,5-Trimethylcyclohexanone |
| CAS Registry Number | 873-94-9 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H16O |
| InChI | InChI=1S/C9H16O/c1-7-4-8(10)6-9(2,3)5-7/h7H,4-6H2,1-3H3 |
| InChIKey | POSWICCRDBKBMH-UHFFFAOYSA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | J. Org. Chem. 44, 1184 (1979). |
| NMR Standard | not reported |
| Observed nucleus | 17O |
| Solvent | Neat liquid |