| SpectraBase Compound ID | 4zC4yiITzFc |
|---|---|
| InChI | InChI=1S/C16H18O2/c1-3-12(4-2)16(17)18-15-10-9-13-7-5-6-8-14(13)11-15/h5-12H,3-4H2,1-2H3 |
| InChIKey | JDKZXLBYHYCZKA-UHFFFAOYSA-N |
| Mol Weight | 242.32 g/mol |
| Molecular Formula | C16H18O2 |
| Exact Mass | 242.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 211ohgCZqPK |
|---|---|
| Name | 2-Ethylbutyric acid, 2-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.130679818 u |
| Formula | C16H18O2 |
| InChI | InChI=1S/C16H18O2/c1-3-12(4-2)16(17)18-15-10-9-13-7-5-6-8-14(13)11-15/h5-12H,3-4H2,1-2H3 |
| InChIKey | JDKZXLBYHYCZKA-UHFFFAOYSA-N |
| Molecular Weight | 242.318 g/mol |
| SMILES | C1=CC=C2C(=C1)C=C(OC(=O)C(CC)CC)C=C2 |