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Details

Stereochemistry ACHIRAL
Molecular Formula C11H15BrFN3O.ClH
Molecular Weight 339.622
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FLUBROBENGUANE HYDROCHLORIDE F-18

SMILES

Cl.NC(=N)NCC1=CC(Br)=C(OCCC[18F])C=C1

InChI

InChIKey=ZMDQPUBVHXGQKW-RGZLCGRTSA-N
InChI=1S/C11H15BrFN3O.ClH/c12-9-6-8(7-16-11(14)15)2-3-10(9)17-5-1-4-13;/h2-3,6H,1,4-5,7H2,(H4,14,15,16);1H/i13-1;

HIDE SMILES / InChI

Molecular Formula C11H15BrFN3O
Molecular Weight 303.161
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

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
8UH77BQN8T
Record Status Validated (UNII)
Record Version