| SpectraBase Compound ID | EmcpuNvT95N |
|---|---|
| InChI | InChI=1S/C16H22O5/c1-3-11-20-15(17)9-6-10-16(18)21-12-13-7-4-5-8-14(13)19-2/h4-5,7-8H,3,6,9-12H2,1-2H3 |
| InChIKey | GZTRRNSOISTGLH-UHFFFAOYSA-N |
| Mol Weight | 294.35 g/mol |
| Molecular Formula | C16H22O5 |
| Exact Mass | 294.146724 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8ySH3J3tNmE |
|---|---|
| Name | Glutaric acid, 2-methoxybenzyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.146723803 u |
| Formula | C16H22O5 |
| InChI | InChI=1S/C16H22O5/c1-3-11-20-15(17)9-6-10-16(18)21-12-13-7-4-5-8-14(13)19-2/h4-5,7-8H,3,6,9-12H2,1-2H3 |
| InChIKey | GZTRRNSOISTGLH-UHFFFAOYSA-N |
| Molecular Weight | 294.347 g/mol |
| SMILES | C(OCC=1C(OC)=CC=CC1)(=O)CCCC(OCCC)=O |