| SpectraBase Compound ID | EBSQWXV9e34 |
|---|---|
| InChI | InChI=1S/C14H16O3/c1-2-3-4-9-16-12-7-5-11-6-8-14(15)17-13(11)10-12/h5-8,10H,2-4,9H2,1H3 |
| InChIKey | AUCNGVTWAHBDRJ-UHFFFAOYSA-N |
| Mol Weight | 232.28 g/mol |
| Molecular Formula | C14H16O3 |
| Exact Mass | 232.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AFBHG3LIVTc |
|---|---|
| Name | 7-(N-Pentyl)oxycoumarin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.109944372 u |
| Formula | C14H16O3 |
| InChI | InChI=1S/C14H16O3/c1-2-3-4-9-16-12-7-5-11-6-8-14(15)17-13(11)10-12/h5-8,10H,2-4,9H2,1H3 |
| InChIKey | AUCNGVTWAHBDRJ-UHFFFAOYSA-N |
| Molecular Weight | 232.279 g/mol |
| SMILES | C1(=CC=C2C(=C1)OC(=O)C=C2)OCCCCC |