basic_info |
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Product_Name: | 3-TROPANYL 4'-TERT-BUTYLATROPATE HYDROCHLORIDE HEMIHYDRATE |
CAS: | 64048-72-2 |
EnglishSynonyms: | 3-TROPANYL 4'-TERT-BUTYLATROPATE HYDROCHLORIDE HEMIHYDRATE |
pro_mdlNumber: | MFCD01744421 |
pro_acceptors: | 3 |
pro_donors: | 0 |
pro_smile: | CC(C)(C)c1ccc(cc1)C(=C)C(=O)OC2C[C@H]3CC[C@@H](C2)N3C.O.Cl |
InChi: | InChI=1S/C21H29NO2.ClH.H2O/c1-14(15-6-8-16(9-7-15)21(2,3)4)20(23)24-19-12-17-10-11-18(13-19)22(17)5;;/h6-9,17-19H,1,10-13H2,2-5H3;1H;1H2/t17-,18+,19?;; |
InChiKey: | InChIKey=ASOSHHKNAWXJBI-NUFBWWOMSA-N |
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