| SpectraBase Compound ID | si3E0isos4 |
|---|---|
| InChI | InChI=1S/C15H14O3/c1-11-3-7-13(8-4-11)17-15(16)18-14-9-5-12(2)6-10-14/h3-10H,1-2H3 |
| InChIKey | IZJIAOFBVVYSMA-UHFFFAOYSA-N |
| Mol Weight | 242.27 g/mol |
| Molecular Formula | C15H14O3 |
| Exact Mass | 242.094294 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5B5GER3p3Ex |
|---|---|
| Name | Carbonic acid, di-p-tolyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.094294308 u |
| Formula | C15H14O3 |
| InChI | InChI=1S/C15H14O3/c1-11-3-7-13(8-4-11)17-15(16)18-14-9-5-12(2)6-10-14/h3-10H,1-2H3 |
| InChIKey | IZJIAOFBVVYSMA-UHFFFAOYSA-N |
| Molecular Weight | 242.274 g/mol |
| SMILES | C=1C(=CC=C(C1)C)OC(OC=1C=CC(=CC1)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.979896 |