| SpectraBase Compound ID | Cn3MXLTASLr |
|---|---|
| InChI | InChI=1S/C11H12O3/c1-8(12)7-9-3-5-10(6-4-9)11(13)14-2/h3-6H,7H2,1-2H3 |
| InChIKey | MMLNFWPLMKLQFK-UHFFFAOYSA-N |
| Mol Weight | 192.21 g/mol |
| Molecular Formula | C11H12O3 |
| Exact Mass | 192.078644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CNuAxCmZ6TR |
|---|---|
| Name | Methyl 4-(2-oxopropyl)benzoate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H12O3 |
| InChI | InChI=1S/C11H12O3/c1-8(12)7-9-3-5-10(6-4-9)11(13)14-2/h3-6H,7H2,1-2H3 |
| InChIKey | MMLNFWPLMKLQFK-UHFFFAOYSA-N |
| Molecular Weight | 192.214 g/mol |
| SMILES | COC(c1ccc(cc1)CC(C)=O)=O |
| SPLASH | splash10-004i-2900000000-20bbdf199aa3cd4e92e5 |
| Source of Spectrum | ASC-360-SM9-3b |
| Wiley ID | 1811908 |