basic_info |
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| Product_Name: | 2-庚酮,7-溴-1-苯基- |
| CAS: | 108695-25-6 |
| 中文同义词: | 2-庚酮,7-溴-1-苯基- |
| EnglishSynonyms: | 2,4,6-OCTATRIENOIC ACID, 7-(3,4-DIHYDRO-4,4-DIMETHYL-2H-1-BENZOPYRAN-6-YL)-3-METHYL-, (E,E,E)- |
| pro_mdlNumber: | MFCD00874340 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | C/C(=C\C(=O)O)/C=C/C=C(\C)/c1ccc2c(c1)C(CCO2)(C)C |
| InChi: | InChI=1S/C20H24O3/c1-14(12-19(21)22)6-5-7-15(2)16-8-9-18-17(13-16)20(3,4)10-11-23-18/h5-9,12-13H,10-11H2,1-4H3,(H,21,22)/b6-5+,14-12+,15-7+ |
| InChiKey: | InChIKey=NNROJUAWMZCOPE-ZFWGQPRBSA-N |
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