| SpectraBase Compound ID | 3R317Ij5SPh |
|---|---|
| InChI | InChI=1S/C10H8O2/c1-3-8-4-6-9(7-5-8)10(11)12-2/h1,4-7H,2H3 |
| InChIKey | JPGRSTBIEYGVNO-UHFFFAOYSA-N |
| Mol Weight | 160.17 g/mol |
| Molecular Formula | C10H8O2 |
| Exact Mass | 160.052429 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1BVfSBePsWF |
|---|---|
| Name | Methyl 4-ethynylbenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H8O2 |
| InChI | InChI=1S/C10H8O2/c1-3-8-4-6-9(7-5-8)10(11)12-2/h1,4-7H,2H3 |
| InChIKey | JPGRSTBIEYGVNO-UHFFFAOYSA-N |
| Molecular Weight | 160.172 g/mol |
| SMILES | C(c1ccc(cc1)C#C)(=O)OC |
| SPLASH | splash10-0h00-0900000000-410e25fdec7cb9ada8b7 |
| Source of Spectrum | KC-61-4051-4 |
| Synonyms | 4-Ethynylbenzoic acid methyl ester |
| Wiley ID | 1628728 |