![1-[(2E)-2-ethylidene-1-methyl-cyclopentyl]acetone](/api/spectrum/DKQO4eASQrr/structure.png?h=300&w=458 "1-[(2E)-2-ethylidene-1-methyl-cyclopentyl]acetone")
| SpectraBase Compound ID | F5RehhR3fQi |
|---|---|
| InChI | InChI=1S/C11H18O/c1-4-10-6-5-7-11(10,3)8-9(2)12/h4H,5-8H2,1-3H3/b10-4+ |
| InChIKey | UXLLGJGQYGXETG-ONNFQVAWSA-N |
| Mol Weight | 166.26 g/mol |
| Molecular Formula | C11H18O |
| Exact Mass | 166.135765 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DKQO4eASQrr |
|---|---|
| Name | 1-[(2E)-2-Ethylidene-1-methyl-cyclopentyl]acetone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.135765199 u |
| Formula | C11H18O |
| InChI | InChI=1S/C11H18O/c1-4-10-6-5-7-11(10,3)8-9(2)12/h4H,5-8H2,1-3H3/b10-4+ |
| InChIKey | UXLLGJGQYGXETG-ONNFQVAWSA-N |
| Molecular Weight | 166.264 g/mol |
| SMILES | C1(\C(=C\C)CCC1)(CC(=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962619 |