| SpectraBase Compound ID | LeINNULpMGN |
|---|---|
| InChI | InChI=1S/C17H34O4/c1-5-7-9-10-11-17(18)21-16(4)14-20-15(3)13-19-12-8-6-2/h15-16H,5-14H2,1-4H3 |
| InChIKey | GPCLPLXOGDQVAV-UHFFFAOYSA-N |
| Mol Weight | 302.5 g/mol |
| Molecular Formula | C17H34O4 |
| Exact Mass | 302.24571 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HolDfB176RJ |
|---|---|
| Name | 1-(1-Butoxypropan-2-yloxy)propan-2-yl heptanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.245709571 u |
| Formula | C17H34O4 |
| InChI | InChI=1S/C17H34O4/c1-5-7-9-10-11-17(18)21-16(4)14-20-15(3)13-19-12-8-6-2/h15-16H,5-14H2,1-4H3 |
| InChIKey | GPCLPLXOGDQVAV-UHFFFAOYSA-N |
| SMILES | CCCCOCC(OCC(OC(CCCCCC)=O)C)C |