| SpectraBase Compound ID | 6tQGRt09niM |
|---|---|
| InChI | InChI=1S/C19H26O4/c1-15-7-5-10-17(13-15)23-19(21)12-6-11-18(20)22-14-16-8-3-2-4-9-16/h5,7,10,13,16H,2-4,6,8-9,11-12,14H2,1H3 |
| InChIKey | CIDUYVMPFNLIRH-UHFFFAOYSA-N |
| Mol Weight | 318.41 g/mol |
| Molecular Formula | C19H26O4 |
| Exact Mass | 318.183109 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 | 32H7u6GqPp1 |
|---|---|
| Name | Glutaric acid, cyclohexylmethyl 3-methylphenyl 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/c1-15-7-5-10-17(13-15)23-19(21)12-6-11-18(20)22-14-16-8-3-2-4-9-16/h5,7,10,13,16H,2-4,6,8-9,11-12,14H2,1H3 |
| InChIKey | CIDUYVMPFNLIRH-UHFFFAOYSA-N |
| Molecular Weight | 318.413 g/mol |
| SMILES | C(CCC(OCC1CCCCC1)=O)C(OC=1C=CC=C(C)C1)=O |