Index

Semmler-Wolff-Reaction

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A

Reactants

Products

Elimination-with-Hydride-Shift-Lg-Sulfonate

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon
R4 = A-Aliphatic-Carbon
R5 = A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Elimination-Lg-Hydroxyl

References: 0,1,2,3,4,5,6

Reactants

Products

Elimination-with-Alkyl-Shift-Lg-Bromine

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon

Reactants

Products

Krapcho-Decarboxylation-GWE-Amide

References: 0,1

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R5 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R6 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R7 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Krapcho-Decarboxylation-GWE-Carboxyl

References: 0,1

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R5 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R6 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Decarboxylation-Carbamic-Acid

References: 0,1

Condition to enforce:

R1 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group-No-Oxygen, A-Alkoxide, Hydroxyl, A-Aliphatic-Nitrogen
R2 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group-No-Oxygen, A-Alkoxide, Hydroxyl, A-Aliphatic-Nitrogen

Reactants

Products

Aza-Grob-Fragmentation-X-Sulfonate

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A
R6 = L-A

Reactants

Products

Krapcho-Decarboxylation-GWE-Carbonyl

References: 0,1

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R5 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R6 = H, A-Aromatic-Carbon, A-Aliphatic-Carbon, Vinyl-Group

Reactants

Products

Halogenation-Amide-w-Thionyl-Chloride

References: 0

Condition to enforce:

R1 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R2 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Elimination-To-Form-Cyclopropanone-Sulfonate

References: 0

Condition to enforce:

R1 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R2 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R3 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R4 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R5 = L-A

Reactants

Products

Quinone-to-Benzene

References: 0

Condition to enforce:

R1 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group, L-A
R2 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group, L-A
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group, L-A

Reactants

Products

Aza-Grob-Fragmentation-X-Chlorine

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A

Reactants

Products

Acetal-Degradation

References: 0,1

Condition to enforce:

R1 = A-Aliphatic-Carbon, A-Aromatic-Carbon
R2 = A-Aliphatic-Carbon, A-Aromatic-Carbon
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Grob-Fragmentation-X-Fluorine

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A
R6 = L-A

Reactants

Products

Halogenation-Alcohol-w-Thionyl-Chloride

References: 0,1

Condition to enforce:

R1 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R2 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Aza-Grob-Fragmentation-X-Iodine

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A

Reactants

Products

Elimination-Water-Imine

References: 0,1

Condition to enforce:

R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group-No-Oxygen, A-Alkoxide, Hydroxyl, A-Aliphatic-Nitrogen

Avoid formation of:

fragment = 3-membered-ring, 4-membered-ring, A-Cyclobutene-Aromatic

Reactants

Products

Elimination-with-Hydride-Shift-Lg-Chlorine

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon
R4 = A-Aliphatic-Carbon

Reactants

Products

Elimination-with-Alkyl-Shift-Lg-Ammonia

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon
R4 = A-Aliphatic-Carbon
R5 = A-Aliphatic-Carbon
R6 = A-Aliphatic-Carbon

Reactants

Products

Elimination-To-Form-Cyclopropanone-Chlorine

References: 0

Condition to enforce:

R1 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R2 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R3 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R4 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Elimination-Alcohol-POCl3

References: 0

Condition to enforce:

R1 = L-A, A-Aromatic-Carbon, Vinyl-Group
R2 = L-A, A-Aromatic-Carbon, Vinyl-Group
R3 = L-A, A-Aromatic-Carbon, Vinyl-Group
R4 = L-A, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Ester-Pyrolysis

References: 0

Condition to enforce:

R1 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R2 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R5 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Elimination-Acyl-Sulfonate

References: 0

Condition to enforce:

R1 = L-A, A-Aromatic-Carbon, Vinyl-Group
R2 = L-A, A-Aromatic-Carbon, Vinyl-Group
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Elimination-Lg-Iodine

References: 0,1,2,3,4,5,6

Reactants

Products

2-Sulfanyl-anol-Degradation

References: 0,1

Condition to enforce:

R1 = A-Aliphatic-Carbon, A-Aromatic-Carbon
R2 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Avoid formation of:

fragment = 3-membered-ring, 4-membered-ring, A-Cyclobutene-Aromatic

Reactants

Products

Corey-Winter-Olefin-Synthesis

References: 0

Condition to enforce:

R1 = L-A, A-Aromatic-Carbon
R2 = L-A, A-Aromatic-Carbon
R3 = L-A, A-Aromatic-Carbon
R4 = L-A, A-Aromatic-Carbon

Reactants

Products

Elimination-with-Alkyl-Shift-Lg-Chlorine

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon

Reactants

Products

Elimination-with-Hydride-Shift-Lg-Bromine

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon
R4 = A-Aliphatic-Carbon

Reactants

Products

Grob-Fragmentation-X-Iodine

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A
R6 = L-A

Reactants

Products

Elimination-Acyl-Bromine

References: 0

Condition to enforce:

R1 = L-A, A-Aromatic-Carbon, Vinyl-Group
R2 = L-A, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Decarboxylation-CG-Nitrite

References: 0,1

Condition to enforce:

R1 = L-A, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Elimination-with-Alkyl-Shift-Lg-Iodine

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon

Reactants

Products

Robinson-Gabriel-Synthesis

References: 0

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = H, A-Aliphatic-Carbon
R2 = H, A-Aliphatic-Carbon
R3 = H, A-Aliphatic-Carbon

Reactants

Products

Chugaev-Elimination

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A

Reactants

Products

Grob-Fragmentation-X-Bromine

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A
R6 = L-A

Reactants

Products

Elimination-Lg-Sulfonate

References: 0,1,2,3,4,5,6

Condition to enforce:

R5 = A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Elimination-Alkene-Lg-Sulfonate

References: 0

Reactants

Products

Decarboxylation-CG-Carbonyl

References: 0,1

Condition to enforce:

R1 = L-A, A-Aromatic-Carbon, Vinyl-Group
R2 = H, A-Aromatic-Carbon, A-Aliphatic-Carbon, Vinyl-Group

Reactants

Products

Elimination-with-Hydride-Shift-Lg-Iodine

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon
R4 = A-Aliphatic-Carbon

Reactants

Products

Elimination-with-Alkyl-Shift-Lg-Sulfonate

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon
R4 = A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Aza-Grob-Fragmentation-X-Bromine

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A

Reactants

Products

Decarboxylation-CG-Carboxyl

References: 0,1

Condition to enforce:

R1 = L-A, A-Aromatic-Carbon, Vinyl-Group
R2 = H, A-Aliphatic-Carbon

Reactants

Products

Elimination-Lg-Ammonia

References: 0,1,2,3,4,5,6

Condition to enforce:

R5 = A-Aliphatic-Carbon, A-Aromatic-Carbon
R6 = A-Aliphatic-Carbon, A-Aromatic-Carbon
R7 = A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Elimination-To-Form-Cyclopropanone-Bromine

References: 0

Condition to enforce:

R1 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R2 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R3 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R4 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Elimination-Amine-Imine

References: 0,1

Condition to enforce:

R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group-No-Oxygen, A-Alkoxide, Hydroxyl, A-Aliphatic-Nitrogen
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group-No-Oxygen, A-Alkoxide, Hydroxyl, A-Aliphatic-Nitrogen
R5 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group-No-Oxygen, A-Alkoxide, Hydroxyl, A-Aliphatic-Nitrogen

Avoid formation of:

fragment = 3-membered-ring, 4-membered-ring, A-Cyclobutene-Aromatic

Reactants

Products

Elimination-Lg-Alkoxide

References: 0,1,2,3,4,5,6

Condition to enforce:

R5 = A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Hemi-Acetal-Degradation

References: 0,1

Condition to enforce:

R1 = A-Aliphatic-Carbon, A-Aromatic-Carbon
R2 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Avoid formation of:

fragment = 3-membered-ring, 4-membered-ring, A-Cyclobutene-Aromatic

Reactants

Products

Krapcho-Decarboxylation-GWE-Sulfonyl

References: 0,1

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R5 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R6 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Elimination-Alkene-Lg-Iodine

References: 0

Reactants

Products

Aza-Grob-Fragmentation-X-Fluorine

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A

Reactants

Products

Amide-Dehydration-SOBr2

References: 0

Condition to enforce:

R1 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Grob-Fragmentation-X-Chlorine

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A
R6 = L-A

Reactants

Products

Elimination-Lg-Chlorine

References: 0,1,2,3,4,5,6

Reactants

Products

Elimination-Acyl-Iodine

References: 0

Condition to enforce:

R1 = L-A, A-Aromatic-Carbon, Vinyl-Group
R2 = L-A, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Elimination-Alkene-Lg-Chlorine

References: 0

Reactants

Products

Sulfanyl-anol-Degradation

References: 0,1

Condition to enforce:

R1 = A-Aliphatic-Carbon, A-Aromatic-Carbon
R2 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Avoid formation of:

fragment = 3-membered-ring, 4-membered-ring, A-Cyclobutene-Aromatic

Reactants

Products

Elimination-To-Form-Cyclopropanone-Iodine

References: 0

Condition to enforce:

R1 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R2 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R3 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group
R4 = L-A, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Amide-Dehydration-SOCl2

References: 0

Condition to enforce:

R1 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Krapcho-Decarboxylation-GWE-Nitrile

References: 0,1

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R5 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Cope-Elimination

References: 0

Condition to enforce:

R1 = H, A-Aliphatic-Carbon
R2 = H, A-Aliphatic-Carbon
R3 = H, A-Aliphatic-Carbon
R4 = H, A-Aliphatic-Carbon
R5 = H, A-Aliphatic-Carbon
R6 = H, A-Aliphatic-Carbon
R7 = A-Aromatic-Carbon, A-Aliphatic-Carbon

Reactants

Products

Elimination-with-Alkyl-Shift-Lg-Hydroxyl

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon

Reactants

Products

Elimination-with-Hydride-Shift-Lg-Ammonia

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon
R4 = A-Aliphatic-Carbon
R5 = A-Aliphatic-Carbon
R6 = A-Aliphatic-Carbon
R7 = A-Aliphatic-Carbon

Reactants

Products

Dithiol-Degradation

References: 0,1

Condition to enforce:

R1 = A-Aliphatic-Carbon, A-Aromatic-Carbon
R2 = A-Aliphatic-Carbon, A-Aromatic-Carbon
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Elimination-Acyl-Chlorine

References: 0

Condition to enforce:

R1 = L-A, A-Aromatic-Carbon, Vinyl-Group
R2 = L-A, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products

Elimination-Alkene-Lg-Bromine

References: 0

Reactants

Products

Elimination-with-Hydride-Shift-Lg-Hydroxyl

References: 0,1,2

Special Conditions : SIDE REACTION

Condition to enforce:

R1 = A-Aliphatic-Carbon
R2 = A-Aliphatic-Carbon
R3 = A-Aliphatic-Carbon
R4 = A-Aliphatic-Carbon

Reactants

Products

Elimination-Lg-Bromine

References: 0,1,2,3,4,5,6

Reactants

Products

Krapcho-Decarboxylation-GWE-Nitrite

References: 0,1

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R4 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon
R5 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon

Reactants

Products

Grob-Fragmentation-X-Sulfonate

References: 0

Condition to enforce:

R1 = L-A
R2 = L-A
R3 = L-A
R4 = L-A
R5 = L-A
R6 = L-A
R7 = L-A

Reactants

Products

Amide-Dehydration-POCl3

References: 0

Condition to enforce:

R1 = H, A-Aliphatic-Carbon, A-Aromatic-Carbon, Vinyl-Group

Reactants

Products