| Properties | Image |
|---|
| MNX_ID | MNXM1183533 |
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| reference | envipathM:...e6d198ecb69f |
| formula | C12H14Cl2O4 |
| global charge | 0 |
| mol weight | 293.146 |
| InChIKey | ZJBZZGBJKRQRDT-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H14Cl2O4/c13-6-1-4-2-9(6,14)12(17)5-3-10(15,11(4,12)16)8-7(5)18-8/h4-8,15-17H,1-3H2 |
| SMILES | OC12CC(C3OC31)C1(O)C3(Cl)CC(CC3Cl)C21O |
MNX internals
| InChI (mnx) | InChI=1/C12H14Cl2O4/c13-6-1-4-2-9(6,14)12(17)5-3-10(15,11(4,12)16)8-7(5)18-8/h4-8,15-17H,1-3H2/t4?,5?,6?,7?,8?,9?,10?,11?,12? |
 |
| SMILES (mnx) | [CH2:1]1[CH:4]2[CH2:2][C:9]([Cl:14])([CH:6]1[Cl:13])[C:12]1([OH:17])[CH:5]3[CH2:3][C:10]([OH:15])([CH:8]4[CH:7]3[O:18]4)[C:11]21[OH:16] |
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