| Properties | Image |
|---|
| MNX_ID | MNXM1173333 |
 |
| reference | envipathM:...5bcd8c84a667 |
| formula | C14H17O4 |
| global charge | -1 |
| mol weight | 249.286 |
| InChIKey | KAEQFSGQDUAWHI-UHFFFAOYSA-M |
| InChI | InChI=1S/C14H18O4/c1-8-5-10(9(2)7-15)12(16)11(6-8)14(3,4)13(17)18/h5-7,9,16H,1-4H3,(H,17,18)/p-1 |
| SMILES | CC1=CC(C(C)(C)C(=O)[O-])=C(O)C(C(C)C=O)=C1 |
MNX internals
| InChI (mnx) | InChI=1/C14H18O4/c1-8-5-10(9(2)7-15)12(16)11(6-8)14(3,4)13(17)18/h5-7,9,16H,1-4H3,(H,17,18)/t9? |
 |
| SMILES (mnx) | [CH3:1][C:8]1=[CH:5][C:10]([CH:9]([CH3:2])[CH:7]=[O:15])=[C:12]([OH:16])[C:11]([C:14]([CH3:3])([CH3:4])[C:13](=[O:17])[OH:18])=[CH:6]1 |
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