| SpectraBase Compound ID | 8IG0vpQNieK |
|---|---|
| InChI | InChI=1S/C14H14O4/c1-4-7-11(14(16)18-3)13(15)10-8-5-6-9-12(10)17-2/h1,5-6,8-9,11H,7H2,2-3H3 |
| InChIKey | JVJACOLNEYUJPB-UHFFFAOYSA-N |
| Mol Weight | 246.26 g/mol |
| Molecular Formula | C14H14O4 |
| Exact Mass | 246.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | INxFAXjreD7 |
|---|---|
| Name | Methyl 2-(2-methoxybenzoyl)pent-4-ynoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H14O4 |
| InChI | InChI=1S/C14H14O4/c1-4-7-11(14(16)18-3)13(15)10-8-5-6-9-12(10)17-2/h1,5-6,8-9,11H,7H2,2-3H3 |
| InChIKey | JVJACOLNEYUJPB-UHFFFAOYSA-N |
| Molecular Weight | 246.262 g/mol |
| SMILES | COC(=O)C(CC#C)C(=O)c1c(cccc1)OC |
| SPLASH | splash10-000i-0900000000-aca8d50dbf4d1d3bcc17 |
| Source of Spectrum | ASC-352-1163/SM6-2n |
| Wiley ID | 1764434 |