| SpectraBase Compound ID | G34L6RYhZOX |
|---|---|
| InChI | InChI=1S/C11H18O2/c1-9(2)6-5-7-10(3)8-11(12)13-4/h6-7H,5,8H2,1-4H3/b10-7- |
| InChIKey | RSFREVOQDWDJHM-YFHOEESVSA-N |
| Mol Weight | 182.26 g/mol |
| Molecular Formula | C11H18O2 |
| Exact Mass | 182.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Iwl3fUMgsCR |
|---|---|
| Name | 3,6-Octadienoic acid, 3,7-dimethyl-, methyl ester, (Z)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.130679818 u |
| Formula | C11H18O2 |
| InChI | InChI=1S/C11H18O2/c1-9(2)6-5-7-10(3)8-11(12)13-4/h6-7H,5,8H2,1-4H3/b10-7- |
| InChIKey | RSFREVOQDWDJHM-YFHOEESVSA-N |
| Molecular Weight | 182.263 g/mol |
| SMILES | C(\C(=C/CC=C(C)C)C)C(OC)=O |