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Details

Stereochemistry RACEMIC
Molecular Formula C14H19NO
Molecular Weight 217.3068
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2'-OXO-PCE

SMILES

CCNC1(CCCCC1=O)C2=CC=CC=C2

InChI

InChIKey=IDLSBAANXISGEI-UHFFFAOYSA-N
InChI=1S/C14H19NO/c1-2-15-14(11-7-6-10-13(14)16)12-8-4-3-5-9-12/h3-5,8-9,15H,2,6-7,10-11H2,1H3

HIDE SMILES / InChI

Molecular Formula C14H19NO
Molecular Weight 217.3068
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
2TRF16U3MR
Record Status Validated (UNII)
Record Version