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EVODEX.1-P6454

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][N:5]([H])[C:4]([C:3]([C:2]([C:1]([H:13])([H:14])[H:15])([H:11])[H:12])([H:9])[H:10])=[O:6]>>[C:1]([C:2]([C:3]([C:4]#[N:5])([H:9])[H:10])([H:11])[H:12])([H:13])([H:14])[H:15].[H][O:6][H]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E85 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:5](-[#6@:4])(-[#7:6](-[H])-[H])=[#8:7]>>[#6:5](-[#6@:4])#[#7:6].[#8:7](-[H])-[H]

EVODEX.1-C747 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#7:1](-[H])-[#6:2]=[#8:3]>>[#7:1]#[#6:2].[H]-[#8:3]-[H]

EVODEX.1-N954 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#7:1](-[H])-[#6:2](=[#8:3])-[#6:4]>>[#7:1]#[#6:2]-[#6:4].[H]-[#8:3]-[H]

EVODEX.1-Em771 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#7:1](-[H])-[#6:2](=[#8:3])-[#6:4]>>[#7:1]#[#6:2]-[#6:4].[H]-[#8:3]-[H]

EVODEX.1-Cm300 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#7:1](-[H])-[#6:2]=[#8:3]>>[#7:1]#[#6:2].[H]-[#8:3]-[H]

EVODEX.1-Nm692 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#7:1](-[H])-[#6:2](=[#8:3])-[#6:4]>>[#7:1]#[#6:2]-[#6:4].[H]-[#8:3]-[H]

Source Full Reactions

EVODEX.1-R7039

Full Reaction Rendering

[H][N:5]([H])[C:4]([C:3]([C:2]([C:1]([H:13])([H:14])[H:15])([H:11])[H:12])([H:9])[H:10])=[O:6]>>[C:1]([C:2]([C:3]([C:4]#[N:5])([H:9])[H:10])([H:11])[H:12])([H:13])([H:14])[H:15].[H][O:6][H]