| SpectraBase Compound ID | 8ORRTIf7GhI |
|---|---|
| InChI | InChI=1S/C12H12O2/c13-12(14)10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5,9H2,(H,13,14) |
| InChIKey | DWKLNORHNSBBGL-UHFFFAOYSA-N |
| Mol Weight | 188.23 g/mol |
| Molecular Formula | C12H12O2 |
| Exact Mass | 188.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 701DeATtdxm |
|---|---|
| Name | 6-Phenylhex-2-ynoic acid |
| Alternate Name(s) | 6-Phenyl-2-hexynoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O2 |
| InChI | InChI=1S/C12H12O2/c13-12(14)10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5,9H2,(H,13,14) |
| InChIKey | DWKLNORHNSBBGL-UHFFFAOYSA-N |
| Molecular Weight | 188.226 g/mol |
| SMILES | OC(C#CCCCc1ccccc1)=O |
| SPLASH | splash10-006x-8900000000-30c17e6f4896d97992b3 |
| Source of Spectrum | F5-2-1509-9a |
| Wiley ID | 1731865 |