Mol:
94-30-4.mol by:chem960.com
ChemDraw08031019472D
…………
0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0000 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7500 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7500 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7500 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 1 0
4 5 1 0
2 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
9 10 1 0
10 11 1 0
9 12 1 0
12 13 2 0
13 6 1 0
M END
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4-甲氧基苯甲酸乙酯 MDL:
MFCD00015151
4-甲氧基苯甲酸乙酯 InChIKey:
FHUODBDRWMIBQP-UHFFFAOYSA-N
4-甲氧基苯甲酸乙酯 Inchi:
1S/C10H12O3/c1-3-13-10(11)8-4-6-9(12-2)7-5-8/h4-7H,3H2,1-2H3
4-甲氧基苯甲酸乙酯 SMILES:
O=C(C1C=CC(OC)=CC=1)OCC
4-甲氧基苯甲酸乙酯 BRN:
2209700