| SpectraBase Compound ID | Gvmvl1PtbBJ |
|---|---|
| InChI | InChI=1S/C19H26O4/c1-2-3-4-5-8-14-22-18(20)16-12-6-7-13-17(16)19(21)23-15-10-9-11-15/h6-7,12-13,15H,2-5,8-11,14H2,1H3 |
| InChIKey | ABZNFCMYBNFNHS-UHFFFAOYSA-N |
| Mol Weight | 318.41 g/mol |
| Molecular Formula | C19H26O4 |
| Exact Mass | 318.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1kymume7wVk |
|---|---|
| Name | Phthalic acid, cyclobutyl heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.183109313 u |
| Formula | C19H26O4 |
| InChI | InChI=1S/C19H26O4/c1-2-3-4-5-8-14-22-18(20)16-12-6-7-13-17(16)19(21)23-15-10-9-11-15/h6-7,12-13,15H,2-5,8-11,14H2,1H3 |
| InChIKey | ABZNFCMYBNFNHS-UHFFFAOYSA-N |
| Molecular Weight | 318.413 g/mol |
| SMILES | CCCCCCCOC(C1=C(C=CC=C1)C(OC1CCC1)=O)=O |