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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H14NO2.Cl
Molecular Weight 167.634
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N,N-TRIMETHYLALANINIUM CHLORIDE

SMILES

[Cl-].C[C@@H](C(O)=O)[N+](C)(C)C

InChI

InChIKey=RLZYIBPGHODCJF-JEDNCBNOSA-N
InChI=1S/C6H13NO2.ClH/c1-5(6(8)9)7(2,3)4;/h5H,1-4H3;1H/t5-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C6H13NO2
Molecular Weight 131.1729
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

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
MU1S22415N
Record Status Validated (UNII)
Record Version