3-ADAMANTAN-1-YL-6-ACETOXYBENZOIC ACID

CAS号
312747-77-6
CCD编号
CCD00082029
分子式
C19 H22 O4
分子量
314.379

基本信息

产品名称: 3-ADAMANTAN-1-YL-6-ACETOXYBENZOIC ACID
CAS: 312747-77-6
英文同义词: 3-ADAMANTAN-1-YL-6-ACETOXYBENZOIC ACID
MDL号: MFCD00168193
氢键受体数量: 4
氢键供体数量: 1
Smile: CC(=O)Oc1ccc(cc1C(=O)O)[C@@]23C[C@H]4C[C@@H](C2)C[C@H](C4)C3
InChi: InChI=1S/C19H22O4/c1-11(20)23-17-3-2-15(7-16(17)18(21)22)19-8-12-4-13(9-19)6-14(5-12)10-19/h2-3,7,12-14H,4-6,8-10H2,1H3,(H,21,22)/t12-,13+,14-,19-
InChiKey: InChIKey=PUYBEUDIKYCSAG-KRFSREQESA-N

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