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Details

Stereochemistry RACEMIC
Molecular Formula C19H27FN4O2
Molecular Weight 362.4417
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-FLUORO-ADB-PINACA, (±)-

SMILES

CC(C)(C)C(NC(=O)C1=NN(CCCCCF)C2=CC=CC=C12)C(N)=O

InChI

InChIKey=SOYDDJYBRCNNIT-UHFFFAOYSA-N
InChI=1S/C19H27FN4O2/c1-19(2,3)16(17(21)25)22-18(26)15-13-9-5-6-10-14(13)24(23-15)12-8-4-7-11-20/h5-6,9-10,16H,4,7-8,11-12H2,1-3H3,(H2,21,25)(H,22,26)

HIDE SMILES / InChI

Molecular Formula C19H27FN4O2
Molecular Weight 362.4417
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
LOL2KQM530
Record Status Validated (UNII)
Record Version