| SpectraBase Compound ID | J6izFYH2IHr |
|---|---|
| InChI | InChI=1S/C13H24O/c1-10-8-9-12(13(10,3)4)7-5-6-11(2)14/h10,12H,5-9H2,1-4H3 |
| InChIKey | SFGIODPLJWEFLO-UHFFFAOYSA-N |
| Mol Weight | 196.33 g/mol |
| Molecular Formula | C13H24O |
| Exact Mass | 196.182715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LPfO6xES8Df |
|---|---|
| Name | 2-Pentanone, 5-(2,2,3-trimethylcyclopentyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.182715392 u |
| Formula | C13H24O |
| InChI | InChI=1S/C13H24O/c1-10-8-9-12(13(10,3)4)7-5-6-11(2)14/h10,12H,5-9H2,1-4H3 |
| InChIKey | SFGIODPLJWEFLO-UHFFFAOYSA-N |
| Molecular Weight | 196.334 g/mol |
| SMILES | C1(CCC(C1(C)C)CCCC(=O)C)C |