| SpectraBase Compound ID | 87lMj49jyAR |
|---|---|
| InChI | InChI=1S/C18H34O5/c1-15(2)7-6-12-22-17(19)8-5-9-18(20)23-14-11-16(3)10-13-21-4/h15-16H,5-14H2,1-4H3 |
| InChIKey | ZGOZOYGRQLJSSS-UHFFFAOYSA-N |
| Mol Weight | 330.5 g/mol |
| Molecular Formula | C18H34O5 |
| Exact Mass | 330.240624 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LTY3lZnWD9x |
|---|---|
| Name | Glutaric acid, isohexyl 5-methoxy-3-methylpentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.240624190 u |
| Formula | C18H34O5 |
| InChI | InChI=1S/C18H34O5/c1-15(2)7-6-12-22-17(19)8-5-9-18(20)23-14-11-16(3)10-13-21-4/h15-16H,5-14H2,1-4H3 |
| InChIKey | ZGOZOYGRQLJSSS-UHFFFAOYSA-N |
| Molecular Weight | 330.465 g/mol |
| SMILES | CC(CCOC(CCCC(OCCCC(C)C)=O)=O)CCOC |