SpectraBase Compound ID | 3lPx6VEH0wP |
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InChI | InChI=1S/C12H12O2/c1-2-3-9-11(12(13)14)10-7-5-4-6-8-10/h4-8,11H,9H2,1H3,(H,13,14) |
InChIKey | CFIPPYCTQSMIIF-UHFFFAOYSA-N |
Mol Weight | 188.23 g/mol |
Molecular Formula | C12H12O2 |
Exact Mass | 188.08373 g/mol |
SpectraBase Spectrum ID | JScRiiyU3K7 |
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Name | 2-Phenyl-4-hexynoic acid |
CAS Registry Number | 79054-20-9 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H12O2 |
InChI | InChI=1S/C12H12O2/c1-2-3-9-11(12(13)14)10-7-5-4-6-8-10/h4-8,11H,9H2,1H3,(H,13,14) |
InChIKey | CFIPPYCTQSMIIF-UHFFFAOYSA-N |
Molecular Weight | 188.226 g/mol |
SMILES | OC(C(c1ccccc1)CC#CC)=O |
SPLASH | splash10-000f-1900000000-29904b99f772880def92 |
Source of Spectrum | C-103-5464-0 |
Wiley ID | 1184854 |