| SpectraBase Compound ID | 2uMETKuK3Rv |
|---|---|
| InChI | InChI=1S/C12H12O2/c1-2-6-11(9-12(13)14)10-7-4-3-5-8-10/h1,3-5,7-8,11H,6,9H2,(H,13,14) |
| InChIKey | MFBKGGTURGCUAO-UHFFFAOYSA-N |
| Mol Weight | 188.23 g/mol |
| Molecular Formula | C12H12O2 |
| Exact Mass | 188.08373 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GwYP3i6yI8y |
|---|---|
| Name | 3-Phenyl-5-hexynoic acid |
| CAS Registry Number | 122019-84-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O2 |
| InChI | InChI=1S/C12H12O2/c1-2-6-11(9-12(13)14)10-7-4-3-5-8-10/h1,3-5,7-8,11H,6,9H2,(H,13,14) |
| InChIKey | MFBKGGTURGCUAO-UHFFFAOYSA-N |
| Molecular Weight | 188.226 g/mol |
| SMILES | OC(CC(CC#C)c1ccccc1)=O |
| SPLASH | splash10-0adi-2900000000-3f68159f2c8438ded97f |
| Source of Spectrum | J-54-3969-7 |
| Wiley ID | 1184923 |