Mol:
112-37-8.mol by:chem960.com
ChemDraw08031019472D
…………
12.2369 1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.5966 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.9563 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 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
1 12 2 0 0 0 0
1 13 1 0 0 0 0
M END
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十一烷酸 MDL: MFCD00002730
十一烷酸 InChIKey: ZDPHROOEEOARMN-UHFFFAOYSA-N
十一烷酸 Inchi: 1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3,(H,12,13)
十一烷酸 SMILES: O([H])C(C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])=O
十一烷酸 BRN: 1759287