Mol:
474010-60-1.mol by:chem960.com
ChemDraw08031019472D
…………
5.4950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 7.0650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7193 7.8500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0790 7.0650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0790 5.4950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 7.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 7 1 0 0 0 0
7 8 2 0 0 0 0
8 3 1 0 0 0 0
2 9 2 0 0 0 0
2 10 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
15 10 1 0 0 0 0
12 16 1 0 0 0 0
M END
如需查看或获取完整mol文件,请关注官方微信公众号(微信搜一搜:Chem960),回复CAS号+“mol”(如回复:98-98-6 mol)免费获取。
(R)-1-苯甲酰基-3-甲基哌嗪盐酸盐 MDL: MFCD05664046
(R)-1-苯甲酰基-3-甲基哌嗪盐酸盐 InChIKey: OMFYILLDCYROOO-HNCPQSOCSA-N
(R)-1-苯甲酰基-3-甲基哌嗪盐酸盐 Inchi: InChI=1S/C12H16N2O.ClH/c1-10-9-14(8-7-13-10)12(15)11-5-3-2-4-6-11;/h2-6,10,13H,7-9H2,1H3;1H/t10-;/m1./s1
(R)-1-苯甲酰基-3-甲基哌嗪盐酸盐 SMILES: C[C@@H]1CN(CCN1)C(=O)C2=CC=CC=C2.Cl