| SpectraBase Compound ID | 68FWEZHMIm5 |
|---|---|
| InChI | InChI=1S/C21H28O2/c1-2-3-4-5-6-7-8-11-17-23-21(22)20-16-12-14-18-13-9-10-15-19(18)20/h9-10,12-16H,2-8,11,17H2,1H3 |
| InChIKey | JHRPWBYOTSGGHF-UHFFFAOYSA-N |
| Mol Weight | 312.45 g/mol |
| Molecular Formula | C21H28O2 |
| Exact Mass | 312.20893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5kPdXNiwW0W |
|---|---|
| Name | 1-Naphthalenecarboxylic acid decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.208930140 u |
| Formula | C21H28O2 |
| InChI | InChI=1S/C21H28O2/c1-2-3-4-5-6-7-8-11-17-23-21(22)20-16-12-14-18-13-9-10-15-19(18)20/h9-10,12-16H,2-8,11,17H2,1H3 |
| InChIKey | JHRPWBYOTSGGHF-UHFFFAOYSA-N |
| Molecular Weight | 312.453 g/mol |
| SMILES | C=12C(C(OCCCCCCCCCC)=O)=CC=CC2=CC=CC1 |