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Details

Stereochemistry RACEMIC
Molecular Formula C10H12BrNO.ClH
Molecular Weight 278.573
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-BROMOMETHCATHINONE HYDROCHLORIDE

SMILES

Cl.CNC(C)C(=O)C1=CC=C(Br)C=C1

InChI

InChIKey=TYWLEEFTZLMGNE-UHFFFAOYSA-N
InChI=1S/C10H12BrNO.ClH/c1-7(12-2)10(13)8-3-5-9(11)6-4-8;/h3-7,12H,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula C10H12BrNO
Molecular Weight 242.112
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
A92A031C7I
Record Status Validated (UNII)
Record Version