SpectraBase Compound ID | IVpmK7024Pz |
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InChI | InChI=1S/C11H20O3/c1-13-8-9-14-11(12)7-6-10-4-2-3-5-10/h10H,2-9H2,1H3 |
InChIKey | YUDDEFFPZOCWJF-UHFFFAOYSA-N |
Mol Weight | 200.28 g/mol |
Molecular Formula | C11H20O3 |
Exact Mass | 200.141245 g/mol |
SpectraBase Spectrum ID | Jle98DQFVqF |
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Name | 3-Cyclopentylpropionic acid, 2-methoxyethyl ester |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 200.141244501 u |
Formula | C11H20O3 |
InChI | InChI=1S/C11H20O3/c1-13-8-9-14-11(12)7-6-10-4-2-3-5-10/h10H,2-9H2,1H3 |
InChIKey | YUDDEFFPZOCWJF-UHFFFAOYSA-N |
Molecular Weight | 200.278 g/mol |
SMILES | C(CCC1CCCC1)(OCCOC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951443 |