(3-Bromo-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid--ammonia (1/1) (Q82955034)

chemical compound

Language	Label	Description	Also known as
English	(3-Bromo-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid--ammonia (1/1)	chemical compound

Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

327.01399115600003 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₀H₁₈BrNO₄S

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC1(C)C2CCC1(CS(=O)(=O)O)C(=O)C2Br.N

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC1(C)C2CC[C@@]1(CS(=O)(=O)O)C(=O)C2Br.N

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C10H15BrO4S.H3N/c1-9(2)6-3-4-10(9,5-16(13,14)15)8(12)7(6)11;/h6-7H,3-5H2,1-2H3,(H,13,14,15);1H3/t6?,7?,10-;/m1./s1

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InChIKey

ARLPLMVJWOUPSH-KUZQZCPWSA-N

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1 reference

matched by identifier from

InChIKey

ARLPLMVJWOUPSH-KUZQZCPWSA-N

DSSTOX compound identifier

DTXCID001399024

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(3-Bromo-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid--ammonia (1/1) (Q82955034)

Statements

Identifiers

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(3-Bromo-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid--ammonia (1/1) (Q82955034)

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