![2-Pentanone, 5-[3-(acetyloxy)cyclopentyl]-](/api/spectrum/JMtf3SqVUlM/structure.png?h=300&w=458 "2-Pentanone, 5-[3-(acetyloxy)cyclopentyl]-")
| SpectraBase Compound ID | 9YRswfngNS1 |
|---|---|
| InChI | InChI=1S/C12H20O3/c1-9(13)4-3-5-11-6-7-12(8-11)15-10(2)14/h11-12H,3-8H2,1-2H3 |
| InChIKey | KXECBGLZRSXUSJ-UHFFFAOYSA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C12H20O3 |
| Exact Mass | 212.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JMtf3SqVUlM |
|---|---|
| Name | 2-Pentanone, 5-[3-(acetyloxy)cyclopentyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.141244501 u |
| Formula | C12H20O3 |
| InChI | InChI=1S/C12H20O3/c1-9(13)4-3-5-11-6-7-12(8-11)15-10(2)14/h11-12H,3-8H2,1-2H3 |
| InChIKey | KXECBGLZRSXUSJ-UHFFFAOYSA-N |
| Molecular Weight | 212.289 g/mol |
| SMILES | C(OC1CC(CCCC(=O)C)CC1)(=O)C |