Mol:
70-11-1.mol by:chem960.com
ChemDraw08031019472D
…………
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 2 0 0 0 0
3 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 9 1 0 0 0 0
9 10 2 0 0 0 0
10 5 1 0 0 0 0
M END
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α-溴代苯乙酮 MDL:
MFCD00000195
α-溴代苯乙酮 InChIKey:
LIGACIXOYTUXAW-UHFFFAOYSA-N
α-溴代苯乙酮 Inchi:
1S/C8H7BrO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H,6H2
α-溴代苯乙酮 SMILES:
C1=CC=C(C=C1)C(=O)CBr
α-溴代苯乙酮 BRN:
606474