basic_info |
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Product_Name: | 5-(3-BROMO-4-METHOXYPHENYL)-3-METHYL-5-OXOPENTANOIC ACID |
EnglishSynonyms: | 5-(3-BROMO-4-METHOXYPHENYL)-3-METHYL-5-OXOPENTANOIC ACID |
pro_mdlNumber: | MFCD17409855 |
pro_acceptors: | 4 |
pro_donors: | 1 |
pro_smile: | CC(CC(=O)c1ccc(c(c1)Br)OC)CC(=O)O |
InChi: | InChI=1S/C13H15BrO4/c1-8(6-13(16)17)5-11(15)9-3-4-12(18-2)10(14)7-9/h3-4,7-8H,5-6H2,1-2H3,(H,16,17) |
InChiKey: | InChIKey=WQJGSWFWTBTRQY-UHFFFAOYSA-N |
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