| SpectraBase Compound ID | 6eaiFcTbyK2 |
|---|---|
| InChI | InChI=1S/C18H26O4/c1-15(2)14-22-18(20)12-6-11-17(19)21-13-7-10-16-8-4-3-5-9-16/h3-5,8-9,15H,6-7,10-14H2,1-2H3 |
| InChIKey | BFCYNWPDZPQZKK-UHFFFAOYSA-N |
| Mol Weight | 306.4 g/mol |
| Molecular Formula | C18H26O4 |
| Exact Mass | 306.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CS1Ibo5moNv |
|---|---|
| Name | Glutaric acid, isobutyl 3-phenylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.183109313 u |
| Formula | C18H26O4 |
| InChI | InChI=1S/C18H26O4/c1-15(2)14-22-18(20)12-6-11-17(19)21-13-7-10-16-8-4-3-5-9-16/h3-5,8-9,15H,6-7,10-14H2,1-2H3 |
| InChIKey | BFCYNWPDZPQZKK-UHFFFAOYSA-N |
| Molecular Weight | 306.402 g/mol |
| SMILES | CC(C)COC(CCCC(OCCCC1=CC=CC=C1)=O)=O |