basic_info |
|
| Product_Name： | 1-(3,5-DIMETHYLPHENYL)PENT-4-YN-2-ONE |
| EnglishSynonyms： | 1-(3,5-DIMETHYLPHENYL)PENT-4-YN-2-ONE |
| pro_mdlNumber： | MFCD16817851 |
| pro_acceptors： | 1 |
| pro_donors： | 0 |
| pro_smile： | Cc1cc(cc(c1)CC(=O)CC#C)C |
| InChi： | InChI=1S/C13H14O/c1-4-5-13(14)9-12-7-10(2)6-11(3)8-12/h1,6-8H,5,9H2,2-3H3 |
| InChiKey： | InChIKey=VTRZIOMMCVOVJW-UHFFFAOYSA-N |
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