| SpectraBase Compound ID | 6Pnsd8HdlJN |
|---|---|
| InChI | InChI=1S/C16H16O3/c17-15-11-5-4-10-14(15)16(18)19-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11,17H,6,9,12H2 |
| InChIKey | GMHNYYKDPGWAJR-UHFFFAOYSA-N |
| Mol Weight | 256.3 g/mol |
| Molecular Formula | C16H16O3 |
| Exact Mass | 256.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LSxZIubbwIp |
|---|---|
| Name | 3-Phenylpropyl salicylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.109944372 u |
| Formula | C16H16O3 |
| InChI | InChI=1S/C16H16O3/c17-15-11-5-4-10-14(15)16(18)19-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11,17H,6,9,12H2 |
| InChIKey | GMHNYYKDPGWAJR-UHFFFAOYSA-N |
| Molecular Weight | 256.301 g/mol |
| SMILES | C(C1=C(O)C=CC=C1)(=O)OCCCC1=CC=CC=C1 |