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EVODEX.1-P1014

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[O:2]=[C:3]([C:4]([C:5]1:[C:6]([H:16]):[C:7]([H:17]):[C:8]([H:18]):[C:9]([H:19]):[C:10]:1[H:20])([H:21])[H:22])[H:23].[H][O:11][O:12][H]>>[H]N([H])[C:3]([H])([C:4]([C:5]1:[C:6]([H:16]):[C:7]([H:17]):[C:8]([H:18]):[C:9]([H:19]):[C:10]:1[H:20])([H:21])[H:22])[H:23].[O:11]=[O:12].[H][O:2][H]

Derived Operators

EVODEX.1-F169 - Elemental Balance

N1
H3

EVODEX.1-M47 - Mass Difference

17.02659

EVODEX.1-E837 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:18]-[#6:19](=[#8:20])-[H:31].[#8:24](-[#8:25]-[H])-[H]>>[#6:18]-[#6:19](-[#7](-[H])-[H])(-[H:31])-[H].[#8:24]=[#8:25].[#8:20](-[H])-[H]

EVODEX.1-C106 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:7]=[#8:8].[H]-[#8:11]-[#8:12]-[H]>>[H]-[#7](-[H])-[#6:7]-[H].[#8:11]=[#8:12].[H]-[#8:8]-[H]

EVODEX.1-N243 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:6]-[#6:7](=[#8:8])-[H:16].[H]-[#8:11]-[#8:12]-[H]>>[H]-[#7](-[H])-[#6:7](-[H])(-[#6:6])-[H:16].[#8:11]=[#8:12].[H]-[#8:8]-[H]

EVODEX.1-Em365 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:6]-[#6:7]=[#8:8].[H]-[#8:11]-[#8:12]-[H]>>[H]-[#7](-[H])-[#6:7](-[H])-[#6:6].[#8:11]=[#8:12].[H]-[#8:8]-[H]

EVODEX.1-Cm131 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:7]=[#8:8].[H]-[#8:11]-[#8:12]-[H]>>[#7]-[#6:7]-[H].[#8:11]=[#8:12].[H]-[#8:8]-[H]

EVODEX.1-Nm325 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:6]-[#6:7]=[#8:8].[H]-[#8:11]-[#8:12]-[H]>>[H]-[#7](-[H])-[#6:7](-[H])-[#6:6].[#8:11]=[#8:12].[H]-[#8:8]-[H]

Source Full Reactions

EVODEX.1-R986

Full Reaction Rendering

[H][N:1]([H:13])[H:14].[O:2]=[C:3]([C:4]([C:5]1:[C:6]([H:16]):[C:7]([H:17]):[C:8]([H:18]):[C:9]([H:19]):[C:10]:1[H:20])([H:21])[H:22])[H:23].[H][O:11][O:12][H]>>[H][C:3]([N:1]([H:13])[H:14])([C:4]([C:5]1:[C:6]([H:16]):[C:7]([H:17]):[C:8]([H:18]):[C:9]([H:19]):[C:10]:1[H:20])([H:21])[H:22])[H:23].[O:11]=[O:12].[H][O:2][H]