| SpectraBase Compound ID | HwE9InX7oGY |
|---|---|
| InChI | InChI=1S/C11H18O4/c1-2-8-14-10(12)6-7-11(13)15-9-4-3-5-9/h9H,2-8H2,1H3 |
| InChIKey | WEAZSHNKQWYWNH-UHFFFAOYSA-N |
| Mol Weight | 214.26 g/mol |
| Molecular Formula | C11H18O4 |
| Exact Mass | 214.120509 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DUNwEzCtD5K |
|---|---|
| Name | Succinic acid, cyclobutyl propyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.120509056 u |
| Formula | C11H18O4 |
| InChI | InChI=1S/C11H18O4/c1-2-8-14-10(12)6-7-11(13)15-9-4-3-5-9/h9H,2-8H2,1H3 |
| InChIKey | WEAZSHNKQWYWNH-UHFFFAOYSA-N |
| Molecular Weight | 214.261 g/mol |
| SMILES | C1(CCC1)OC(CCC(=O)OCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.929322 |