| SpectraBase Compound ID | 6vf8UB3sRdD |
|---|---|
| InChI | InChI=1S/C17H24O4/c1-3-14(2)13-21-17(19)10-9-16(18)20-12-11-15-7-5-4-6-8-15/h4-8,14H,3,9-13H2,1-2H3 |
| InChIKey | ZJUFXWGPUVVJHF-UHFFFAOYSA-N |
| Mol Weight | 292.38 g/mol |
| Molecular Formula | C17H24O4 |
| Exact Mass | 292.167459 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BEUpbQNrbRk |
|---|---|
| Name | Succinic acid, phenethyl 2-methylbutyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.167459249 u |
| Formula | C17H24O4 |
| InChI | InChI=1S/C17H24O4/c1-3-14(2)13-21-17(19)10-9-16(18)20-12-11-15-7-5-4-6-8-15/h4-8,14H,3,9-13H2,1-2H3 |
| InChIKey | ZJUFXWGPUVVJHF-UHFFFAOYSA-N |
| SMILES | CCC(C)COC(CCC(OCCC1=CC=CC=C1)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9363 |