Mol:
14381-41-0.mol by:chem960.com
ChemDraw08031019472D
…………
5.7523 4.5753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 2.3550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 1 1 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
1 9 1 0 0 0 0
9 10 2 0 0 0 0
9 11 1 0 0 0 0
M END
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苯并环丁烯-1-羧酸 MDL: MFCD00001351
苯并环丁烯-1-羧酸 InChIKey: NYOXTUZNVYEODT-UHFFFAOYSA-N
苯并环丁烯-1-羧酸 Inchi: InChI=1S/C9H8O2/c10-9(11)8-5-6-3-1-2-4-7(6)8/h1-4,8H,5H2,(H,10,11)
苯并环丁烯-1-羧酸 SMILES: C1=CC=C2C(=C1)CC2C(=O)O