| SpectraBase Compound ID | I3BgPjmPYME |
|---|---|
| InChI | InChI=1S/C16H30O5/c1-4-6-7-14(10-12-19-3)13-21-16(18)9-8-15(17)20-11-5-2/h14H,4-13H2,1-3H3 |
| InChIKey | LUBRNCBXSIQBLQ-UHFFFAOYSA-N |
| Mol Weight | 302.41 g/mol |
| Molecular Formula | C16H30O5 |
| Exact Mass | 302.209324 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GzEEKRnbj8j |
|---|---|
| Name | Succinic acid, 2-(2-methoxyethyl)hexyl propyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.209324061 u |
| Formula | C16H30O5 |
| InChI | InChI=1S/C16H30O5/c1-4-6-7-14(10-12-19-3)13-21-16(18)9-8-15(17)20-11-5-2/h14H,4-13H2,1-3H3 |
| InChIKey | LUBRNCBXSIQBLQ-UHFFFAOYSA-N |
| SMILES | C(OCC(CCOC)CCCC)(CCC(OCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.926332 |