Mol:
15450-76-7.mol by:chem960.com
ChemDraw08031019472D
…………
0 0 0 0 0 0 0
4.0790 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4401 3.1402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4404 4.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 3.1400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 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 9 2 0 0 0 0
9 4 1 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
11 2 1 0 0 0 0
5 12 1 0 0 0 0
M END
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2,8-喹啉二醇 MDL: MFCD01838229
2,8-喹啉二醇 InChIKey: ZXZKYYHTWHJHFT-UHFFFAOYSA-N
2,8-喹啉二醇 Inchi: 1S/C9H7NO2/c11-7-3-1-2-6-4-5-8(12)10-9(6)7/h1-5,11H,(H,10,12)
2,8-喹啉二醇 SMILES: O([H])C1=C([H])C([H])=C([H])C2C([H])=C([H])C(N([H])C=21)=O
2,8-喹啉二醇 BRN: 472906