basic_info |
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| Product_Name: | 1-(3-BROMOBENZYL)-4-METHYL-2,6,7-TRIOXABICYCLO[2.2.2]OCTANE |
| CAS: | 951885-61-3 |
| EnglishSynonyms: | 1-(3-BROMOBENZYL)-4-METHYL-2,6,7-TRIOXABICYCLO[2.2.2]OCTANE |
| pro_mdlNumber: | MFCD09878416 |
| pro_acceptors: | 3 |
| pro_donors: | 0 |
| pro_smile: | C[C@@]12CO[C@@](OC1)(OC2)Cc3cccc(c3)Br |
| InChi: | InChI=1S/C13H15BrO3/c1-12-7-15-13(16-8-12,17-9-12)6-10-3-2-4-11(14)5-10/h2-5H,6-9H2,1H3/t12-,13+ |
| InChiKey: | InChIKey=QJWQIXCPAVGZDM-BETUJISGSA-N |
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