Mol:
14704-31-5.mol by:chem960.com
ChemDraw08031019472D
…………
5.4386 3.1400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7983 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7983 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4386 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0790 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 8 1 0 0 0 0
8 3 2 0 0 0 0
5 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 9 1 0 0 0 0
M END
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3-苯基苄基溴 MDL: MFCD03452790
3-苯基苄基溴 InChIKey: RTFPTPXBTIUISM-UHFFFAOYSA-N
3-苯基苄基溴 Inchi: 1S/C13H11Br/c14-10-11-5-4-8-13(9-11)12-6-2-1-3-7-12/h1-9H,10H2
3-苯基苄基溴 SMILES: BrC([H])([H])C1C([H])=C([H])C([H])=C(C=1[H])C1C([H])=C([H])C([H])=C([H])C=1[H]