| SpectraBase Compound ID | 6np1sQuxS0w |
|---|---|
| InChI | InChI=1S/C17H18O3/c1-12(2)13-8-10-14(11-9-13)20-17(18)15-6-4-5-7-16(15)19-3/h4-12H,1-3H3 |
| InChIKey | SZUAYFDDKTZDHG-UHFFFAOYSA-N |
| Mol Weight | 270.33 g/mol |
| Molecular Formula | C17H18O3 |
| Exact Mass | 270.125594 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2oM7neIBEvj |
|---|---|
| Name | 2-Methoxybenzoic acid, 4-isopropylphenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.125594437 u |
| Formula | C17H18O3 |
| InChI | InChI=1S/C17H18O3/c1-12(2)13-8-10-14(11-9-13)20-17(18)15-6-4-5-7-16(15)19-3/h4-12H,1-3H3 |
| InChIKey | SZUAYFDDKTZDHG-UHFFFAOYSA-N |
| SMILES | CC(C)C1=CC=C(OC(C2=C(C=CC=C2)OC)=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.809002 |