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Details

Stereochemistry ACHIRAL
Molecular Formula C14H17F3N3O2
Molecular Weight 316.2989
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of TDBZCHOLINE

SMILES

C[N+](C)(C)CCOC(=O)C1=CC=C(C=C1)C2(N=N2)C(F)(F)F

InChI

InChIKey=IQGNIBHYFCIEEE-UHFFFAOYSA-N
InChI=1S/C14H17F3N3O2/c1-20(2,3)8-9-22-12(21)10-4-6-11(7-5-10)13(18-19-13)14(15,16)17/h4-7H,8-9H2,1-3H3/q+1

HIDE SMILES / InChI

Molecular Formula C14H17F3N3O2
Molecular Weight 316.2989
Charge 1
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
NTU9QE4VZL
Record Status Validated (UNII)
Record Version