| Properties | Image |
MNX_ID | MNXM164087 |
 |
reference | sabiorkM:25621 |
formula | C8H8O2 |
global charge | 0 |
mol weight | 136.15 |
InChIKey | MYKLQMNSFPAPLZ-UHFFFAOYSA-N |
InChI | InChI=1S/C8H8O2/c1-5-3-8(10)6(2)4-7(5)9/h3-4H,1-2H3 |
SMILES | CC1=CC(=O)C(C)=CC1=O |
MNX internals
InChI (mnx) | InChI=1/C8H8O2/c1-5-3-8(10)6(2)4-7(5)9/h3-4H,1-2H3 |
 |
SMILES (mnx) | [CH3:1][C:5]1=[CH:3][C:8](=[O:10])[C:6]([CH3:2])=[CH:4][C:7]1=[O:9] |
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