| SpectraBase Compound ID | z6mJcDZbK1 |
|---|---|
| InChI | InChI=1S/C19H28O5/c1-3-4-5-6-7-15-23-18(20)9-8-10-19(21)24-17-13-11-16(22-2)12-14-17/h11-14H,3-10,15H2,1-2H3 |
| InChIKey | JBOCPFUSEFWGAK-UHFFFAOYSA-N |
| Mol Weight | 336.43 g/mol |
| Molecular Formula | C19H28O5 |
| Exact Mass | 336.193674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fpxj8JYB82w |
|---|---|
| Name | Glutaric acid, heptyl 4-methoxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.193673997 u |
| Formula | C19H28O5 |
| InChI | InChI=1S/C19H28O5/c1-3-4-5-6-7-15-23-18(20)9-8-10-19(21)24-17-13-11-16(22-2)12-14-17/h11-14H,3-10,15H2,1-2H3 |
| InChIKey | JBOCPFUSEFWGAK-UHFFFAOYSA-N |
| Molecular Weight | 336.428 g/mol |
| SMILES | CCCCCCCOC(CCCC(OC1=CC=C(C=C1)OC)=O)=O |