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Details

Stereochemistry ACHIRAL
Molecular Formula C9H14N.C6H5O3S
Molecular Weight 293.381
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYLTRIMETHYLAMMONIUM BESYLATE

SMILES

C[N+](C)(C)C1=CC=CC=C1.[O-]S(=O)(=O)C2=CC=CC=C2

InChI

InChIKey=XQQLGIPIFXUSET-UHFFFAOYSA-M
InChI=1S/C9H14N.C6H6O3S/c1-10(2,3)9-7-5-4-6-8-9;7-10(8,9)6-4-2-1-3-5-6/h4-8H,1-3H3;1-5H,(H,7,8,9)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C6H5O3S
Molecular Weight 157.167
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C9H14N
Molecular Weight 136.2142
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:51:44 GMT 2023
Edited
by admin
on Sat Dec 16 12:51:44 GMT 2023
Record UNII
2QNZ294Q5O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHENYLTRIMETHYLAMMONIUM BESYLATE
Common Name English
BENZENAMINIUM, N,N,N-TRIMETHYL-, BENZENESULFONATE (1:1)
Systematic Name English
NSC-108349
Code English
BENZENAMINIUM, N,N,N-TRIMETHYL-, BENZENESULFONATE
Systematic Name English
Code System Code Type Description
CAS
16093-66-6
Created by admin on Sat Dec 16 12:51:44 GMT 2023 , Edited by admin on Sat Dec 16 12:51:44 GMT 2023
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FDA UNII
2QNZ294Q5O
Created by admin on Sat Dec 16 12:51:44 GMT 2023 , Edited by admin on Sat Dec 16 12:51:44 GMT 2023
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NSC
108349
Created by admin on Sat Dec 16 12:51:44 GMT 2023 , Edited by admin on Sat Dec 16 12:51:44 GMT 2023
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EPA CompTox
DTXSID2066010
Created by admin on Sat Dec 16 12:51:44 GMT 2023 , Edited by admin on Sat Dec 16 12:51:44 GMT 2023
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PUBCHEM
85279
Created by admin on Sat Dec 16 12:51:44 GMT 2023 , Edited by admin on Sat Dec 16 12:51:44 GMT 2023
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