Mol:
14763-60-1.mol by:chem960.com
ChemDraw08031019472D
…………
0 0 0
1.3597 3.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7193 4.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0790 3.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 4.4997 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
2 4 2 0 0 0 0
2 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
8 11 1 0 0 0 0
M END
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4-甲基磺酰苯酚 MDL: MFCD00047806
4-甲基磺酰苯酚 InChIKey: KECCFSZFXLAGJS-UHFFFAOYSA-N
4-甲基磺酰苯酚 Inchi: 1S/C7H8O3S/c1-11(9,10)7-4-2-6(8)3-5-7/h2-5,8H,1H3
4-甲基磺酰苯酚 SMILES: S(C([H])([H])[H])(C1C([H])=C([H])C(=C([H])C=1[H])O[H])(=O)=O