EVODEX.1-P106

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:3]([C:2]#[C:1][H:10])([O:4][H])[H:8].[O:5]=[O:6]>>[C:1](#[C:2][C:3](=[O:4])[H:8])[H:10].[H][O:5][O:6][H]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-C40 - Reaction Operator C

Reaction Operator C SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4]-[H]>>[#8:3]=[#6:4].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-N81 - Reaction Operator N

Reaction Operator N SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#6:5])-[H:21]>>[#8:3]=[#6:4](-[#6:5])-[H:21].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Em179 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])-[#6:5]=[#6:6]>>[#8:3]=[#6:4]-[#6:5]=[#6:6].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Cm63 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4]-[H]>>[#8:3]=[#6:4].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Nm94 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])-[#6:5]>>[#8:3]=[#6:4]-[#6:5].[H]-[#8:1]-[#8:2]-[H]

Source Full Reactions

EVODEX.1-R139

Full Reaction Rendering

[H][C:3]([C:2]#[C:1][H:10])([O:4][H])[H:8].[O:5]=[O:6]>>[C:1](#[C:2][C:3](=[O:4])[H:8])[H:10].[H][O:5][O:6][H]