| SpectraBase Compound ID | 6P5cCgWP2iZ |
|---|---|
| InChI | InChI=1S/C11H10O3/c1-3-8-14-10-6-4-9(5-7-10)11(12)13-2/h1,4-7H,8H2,2H3 |
| InChIKey | XKJNBFLFMDCBOH-UHFFFAOYSA-N |
| Mol Weight | 190.2 g/mol |
| Molecular Formula | C11H10O3 |
| Exact Mass | 190.062994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EOohu9CyqId |
|---|---|
| Name | 4-Prop-2-ynoxybenzoic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.062994179 u |
| Formula | C11H10O3 |
| InChI | InChI=1S/C11H10O3/c1-3-8-14-10-6-4-9(5-7-10)11(12)13-2/h1,4-7H,8H2,2H3 |
| InChIKey | XKJNBFLFMDCBOH-UHFFFAOYSA-N |
| Molecular Weight | 190.198 g/mol |
| SMILES | C=1(C(=O)OC)C=CC(=CC1)OCC#C |