| SpectraBase Compound ID | LPZtzXyLNBA |
|---|---|
| InChI | InChI=1S/C18H32O5/c1-4-6-7-8-10-16(11-9-15-21-3)23-18(20)13-12-17(19)22-14-5-2/h12-13,16H,4-11,14-15H2,1-3H3/b13-12+ |
| InChIKey | VIXGOUCBLJBRDU-OUKQBFOZSA-N |
| Mol Weight | 328.4 g/mol |
| Molecular Formula | C18H32O5 |
| Exact Mass | 328.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D7EX2ajeWPx |
|---|---|
| Name | Fumaric acid, 1-methoxydec-4-yl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.224974125 u |
| Formula | C18H32O5 |
| InChI | InChI=1S/C18H32O5/c1-4-6-7-8-10-16(11-9-15-21-3)23-18(20)13-12-17(19)22-14-5-2/h12-13,16H,4-11,14-15H2,1-3H3/b13-12+ |
| InChIKey | VIXGOUCBLJBRDU-OUKQBFOZSA-N |
| Molecular Weight | 328.449 g/mol |
| SMILES | CCCOC(\C=C\C(OC(CCCOC)CCCCCC)=O)=O |