| SpectraBase Compound ID | 9lgD5G1CPmR |
|---|---|
| InChI | InChI=1S/C19H28O3/c1-4-6-7-8-12-15-18(19(20)21-5-2)16(3)22-17-13-10-9-11-14-17/h9-11,13-14H,4-8,12,15H2,1-3H3/b18-16- |
| InChIKey | YYCISFMEHSPYOP-VLGSPTGOSA-N |
| Mol Weight | 304.43 g/mol |
| Molecular Formula | C19H28O3 |
| Exact Mass | 304.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A9M8MKJEhQm |
|---|---|
| Name | (Z)-Ethyl 2-(1-phenoxyethylidene)nonanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.203844759 u |
| Formula | C19H28O3 |
| InChI | InChI=1S/C19H28O3/c1-4-6-7-8-12-15-18(19(20)21-5-2)16(3)22-17-13-10-9-11-14-17/h9-11,13-14H,4-8,12,15H2,1-3H3/b18-16- |
| InChIKey | YYCISFMEHSPYOP-VLGSPTGOSA-N |
| Molecular Weight | 304.430 g/mol |
| SMILES | C(C)OC(\C(=C\(C)OC=1C=CC=CC1)CCCCCCC)=O |