| SpectraBase Compound ID | 3A6neSfGJ2x |
|---|---|
| InChI | InChI=1S/C19H28O5/c1-3-13-23-18(20)9-10-19(21)24-15-12-17(11-14-22-2)16-7-5-4-6-8-16/h4-8,17H,3,9-15H2,1-2H3 |
| InChIKey | YGRASEQFUUHTTE-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 | EVCweRCL87A |
|---|---|
| Name | Succinic acid, 5-methoxy-3-phenylpentyl propyl 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/c1-3-13-23-18(20)9-10-19(21)24-15-12-17(11-14-22-2)16-7-5-4-6-8-16/h4-8,17H,3,9-15H2,1-2H3 |
| InChIKey | YGRASEQFUUHTTE-UHFFFAOYSA-N |
| Molecular Weight | 336.428 g/mol |
| SMILES | C(COC(CCC(OCCC(C1=CC=CC=C1)CCOC)=O)=O)C |