basic_info |
|
| Product_Name: | 2,2-DIMETHYL-BUT-3-YNOIC ACID BENZYL ESTER |
| CAS: | 204588-77-2 |
| EnglishSynonyms: | BENZYL 2,2-DIMETHYLBUT-3-YNOATE ; 2,2-DIMETHYL-BUT-3-YNOIC ACID BENZYL ESTER |
| pro_mdlNumber: | MFCD03093341 |
| pro_acceptors: | 2 |
| pro_donors: | 0 |
| pro_smile: | CC(C)(C#C)C(=O)OCc1ccccc1 |
| InChi: | InChI=1S/C13H14O2/c1-4-13(2,3)12(14)15-10-11-8-6-5-7-9-11/h1,5-9H,10H2,2-3H3 |
| InChiKey: | InChIKey=IVGCYRWSEREWFF-UHFFFAOYSA-N |
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