| SpectraBase Compound ID | LxrwB5SmlL7 |
|---|---|
| InChI | InChI=1S/C10H16O2/c1-4-8-7(2)5-6-10(8,3)9(11)12/h4-6H2,1-3H3,(H,11,12) |
| InChIKey | CDURUZDMQAUUOA-UHFFFAOYSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 73007WVl4Vu |
|---|---|
| Name | 2-Ethyl-1,3-dimethylcyclopent-2-enecarboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c1-4-8-7(2)5-6-10(8,3)9(11)12/h4-6H2,1-3H3,(H,11,12) |
| InChIKey | CDURUZDMQAUUOA-UHFFFAOYSA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | C(=O)(C1(C)CCC(=C1CC)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.926553 |