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EVODEX.1-P5925

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

N#[C:2][C:3]([C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([N+:8](=[O:9])[O-:10]):[C:11]([H:17]):[C:12]:1[H:18])([H:19])[H:20]>>[H]O[C:2](=O)[C:3]([C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([N+:8](=[O:9])[O-:10]):[C:11]([H:17]):[C:12]:1[H:18])([H:19])[H:20]

Derived Operators

EVODEX.1-F492 - Elemental Balance

O2
N-1
H1

EVODEX.1-M81 - Mass Difference

18.994529999999997

EVODEX.1-E1310 - Reaction Operator E

Reaction Operator E SMIRKS

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

EVODEX.1-C138 - Reaction Operator C

Reaction Operator C SMIRKS

[#7]#[#6:2]>>[H]-[#8]-[#6:2]=[#8]

EVODEX.1-N59 - Reaction Operator N

Reaction Operator N SMIRKS

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

EVODEX.1-Em133 - Reaction Operator Em

Reaction Operator Em SMIRKS

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

EVODEX.1-Cm107 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7]#[#6:2]>>[#8]-[#6:2]=[#8]

EVODEX.1-Nm90 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

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

Source Full Reactions

EVODEX.1-R6588

Full Reaction Rendering

[N:1]#[C:2][C:3]([C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([N+:8](=[O:9])[O-:10]):[C:11]([H:17]):[C:12]:1[H:18])([H:19])[H:20].[H][O:13][H].[H][O:14][H:23]>>[C:2]([C:3]([C:4]1:[C:5]([H:15]):[C:6]([H:16]):[C:7]([N+:8](=[O:9])[O-:10]):[C:11]([H:17]):[C:12]:1[H:18])([H:19])[H:20])(=[O:13])[O:14][H:23].[H][N:1]([H])[H]