| SpectraBase Compound ID | 2xwng0MxlUI |
|---|---|
| InChI | InChI=1S/C13H24O3/c1-4-5-6-7-9-12(15-2)10-8-11-13(14)16-3/h8,11-12H,4-7,9-10H2,1-3H3/b11-8+ |
| InChIKey | VGWXQKUQFXVWFF-DHZHZOJOSA-N |
| Mol Weight | 228.33 g/mol |
| Molecular Formula | C13H24O3 |
| Exact Mass | 228.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7mtOQ11bBLr |
|---|---|
| Name | Methyl (E)-5-methoxyundec-2-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.172544630 u |
| Formula | C13H24O3 |
| InChI | InChI=1S/C13H24O3/c1-4-5-6-7-9-12(15-2)10-8-11-13(14)16-3/h8,11-12H,4-7,9-10H2,1-3H3/b11-8+ |
| InChIKey | VGWXQKUQFXVWFF-DHZHZOJOSA-N |
| Molecular Weight | 228.332 g/mol |
| SMILES | C(\C=C\CC(CCCCCC)OC)(=O)OC |