| SpectraBase Compound ID | 78BbhxESmxv |
|---|---|
| InChI | InChI=1S/C16H22O2/c1-6-8-14(7-2)18-16(17)15-12(4)9-11(3)10-13(15)5/h6,8-10,14H,7H2,1-5H3/b8-6+ |
| InChIKey | ZBLMIFIZYBAZJO-SOFGYWHQSA-N |
| Mol Weight | 246.35 g/mol |
| Molecular Formula | C16H22O2 |
| Exact Mass | 246.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6sqtCv5XeyV |
|---|---|
| Name | 1-Ethyl-trans-2-butenyl 2,4,6-trimethylbenzoate, (.+/-.)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.161979946 u |
| Formula | C16H22O2 |
| InChI | InChI=1S/C16H22O2/c1-6-8-14(7-2)18-16(17)15-12(4)9-11(3)10-13(15)5/h6,8-10,14H,7H2,1-5H3/b8-6+ |
| InChIKey | ZBLMIFIZYBAZJO-SOFGYWHQSA-N |
| Molecular Weight | 246.350 g/mol |
| SMILES | C1(=C(C(=CC(=C1)C)C)C(OC(\C=C\C)CC)=O)C |