Mol:
110-94-1.mol by:chem960.com
ChemDraw08031019472D
…………
0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7983 0.0000 0.0000 O 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 2 0 0 0 0
5 7 1 0 0 0 0
1 8 2 0 0 0 0
1 9 1 0 0 0 0
M END
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戊二酸 MDL: MFCD00004410
戊二酸 InChIKey: JFCQEDHGNNZCLN-UHFFFAOYSA-N
戊二酸 Inchi: 1S/C5H8O4/c6-4(7)2-1-3-5(8)9/h1-3H2,(H,6,7)(H,8,9)
戊二酸 SMILES: O([H])C(C([H])([H])C([H])([H])C([H])([H])C(=O)O[H])=O
戊二酸 BRN: 1209725