basic_info |
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Product_Name: | 1-(2,3-DIHYDROXYPHENYL)-2-METHYL-5-HEXEN-1-ONE |
CAS: | 526208-41-3 |
EnglishSynonyms: | 5-HEXEN-1-ONE, 1-(2,3-DIHYDROXYPHENYL)-2-METHYL- ; 1-(2,3-DIHYDROXYPHENYL)-2-METHYL-5-HEXEN-1-ONE |
pro_mdlNumber: | MFCD18821586 |
pro_acceptors: | 3 |
pro_donors: | 2 |
pro_smile: | CC(CCC=C)C(=O)c1cccc(c1O)O |
InChi: | InChI=1S/C13H16O3/c1-3-4-6-9(2)12(15)10-7-5-8-11(14)13(10)16/h3,5,7-9,14,16H,1,4,6H2,2H3 |
InChiKey: | InChIKey=RMCUQJXZBNPLCE-UHFFFAOYSA-N |
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