| SpectraBase Compound ID | 3V9B3adHJsU |
|---|---|
| InChI | InChI=1S/C18H22O2/c1-2-3-4-5-8-14-20-18(19)17-13-9-11-15-10-6-7-12-16(15)17/h6-7,9-13H,2-5,8,14H2,1H3 |
| InChIKey | HJGGPWDWQBTWMQ-UHFFFAOYSA-N |
| Mol Weight | 270.37 g/mol |
| Molecular Formula | C18H22O2 |
| Exact Mass | 270.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EgRLb62Rd6p |
|---|---|
| Name | 1-Naphthalenecarboxylic acid heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.161979946 u |
| Formula | C18H22O2 |
| InChI | InChI=1S/C18H22O2/c1-2-3-4-5-8-14-20-18(19)17-13-9-11-15-10-6-7-12-16(15)17/h6-7,9-13H,2-5,8,14H2,1H3 |
| InChIKey | HJGGPWDWQBTWMQ-UHFFFAOYSA-N |
| Molecular Weight | 270.372 g/mol |
| SMILES | C=12C(C(OCCCCCCC)=O)=CC=CC2=CC=CC1 |