| Properties | Image |
MNX_ID | MNXM819736 |
 |
reference | sabiorkM:30696 |
formula | C7H8O2 |
global charge | 0 |
mol weight | 124.139 |
InChIKey | JBZMWFIPCADPNP-UHFFFAOYSA-N |
InChI | InChI=1S/C7H8O2/c1-9-7-4-2-6(8)3-5-7/h2,4-5H,3H2,1H3 |
SMILES | COC1=CCC(=O)C=C1 |
MNX internals
InChI (mnx) | InChI=1/C7H8O2/c1-9-7-4-2-6(8)3-5-7/h2,4-5H,3H2,1H3 |
 |
SMILES (mnx) | [CH3:1][O:9][C:7]1=[CH:5][CH2:3][C:6](=[O:8])[CH:2]=[CH:4]1 |
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