| SpectraBase Compound ID | FKr5EDCGrlw |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-7(2)6-11-9(10)8-4-3-5-8/h7-8H,3-6H2,1-2H3 |
| InChIKey | AGOLFBXRMCADSA-UHFFFAOYSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4pGT3GV1csn |
|---|---|
| Name | Cyclobutanecarboxylic acid, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.115029753 u |
| Formula | C9H16O2 |
| InChI | InChI=1S/C9H16O2/c1-7(2)6-11-9(10)8-4-3-5-8/h7-8H,3-6H2,1-2H3 |
| InChIKey | AGOLFBXRMCADSA-UHFFFAOYSA-N |
| Molecular Weight | 156.225 g/mol |
| SMILES | C1C(CC1)C(OCC(C)C)=O |