| SpectraBase Compound ID | 4rbAHlt21ON |
|---|---|
| InChI | InChI=1S/C12H12O2/c1-14-12(13)11-8-4-6-9-5-2-3-7-10(9)11/h2-5,7-8,11H,6H2,1H3 |
| InChIKey | PLBCBDWEJASPRS-UHFFFAOYSA-N |
| Mol Weight | 188.23 g/mol |
| Molecular Formula | C12H12O2 |
| Exact Mass | 188.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FBiF2OjFlOI |
|---|---|
| Name | 1-Naphthalenecarboxylic acid, 1,4-dihydro-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.083729624 u |
| Formula | C12H12O2 |
| InChI | InChI=1S/C12H12O2/c1-14-12(13)11-8-4-6-9-5-2-3-7-10(9)11/h2-5,7-8,11H,6H2,1H3 |
| InChIKey | PLBCBDWEJASPRS-UHFFFAOYSA-N |
| Molecular Weight | 188.226 g/mol |
| SMILES | C1(C2=C(C=CC=C2)CC=C1)C(=O)OC |