| SpectraBase Compound ID | 9KmazI2jvq0 |
|---|---|
| InChI | InChI=1S/C25H36O2/c1-2-3-4-5-6-7-8-9-10-11-14-20-27-25(26)21-23-18-15-17-22-16-12-13-19-24(22)23/h12-13,15-19H,2-11,14,20-21H2,1H3 |
| InChIKey | CEXDNJXKGYFGNU-UHFFFAOYSA-N |
| Mol Weight | 368.6 g/mol |
| Molecular Formula | C25H36O2 |
| Exact Mass | 368.27153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GNGQ5nw6Gr7 |
|---|---|
| Name | 1-Naphthaleneacetic acid, tridecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 368.271530397 u |
| Formula | C25H36O2 |
| InChI | InChI=1S/C25H36O2/c1-2-3-4-5-6-7-8-9-10-11-14-20-27-25(26)21-23-18-15-17-22-16-12-13-19-24(22)23/h12-13,15-19H,2-11,14,20-21H2,1H3 |
| InChIKey | CEXDNJXKGYFGNU-UHFFFAOYSA-N |
| Molecular Weight | 368.561 g/mol |
| SMILES | C1=CC2=C(C=C1)C(=CC=C2)CC(=O)OCCCCCCCCCCCCC |