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Details

Stereochemistry ACHIRAL
Molecular Formula C12H20NO
Molecular Weight 194.2933
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of EMILIUM

SMILES

CC[N+](C)(C)CC1=CC=CC(OC)=C1

InChI

InChIKey=AAKPJTCJKGHSJF-UHFFFAOYSA-N
InChI=1S/C12H20NO/c1-5-13(2,3)10-11-7-6-8-12(9-11)14-4/h6-9H,5,10H2,1-4H3/q+1

HIDE SMILES / InChI

Molecular Formula C12H20NO
Molecular Weight 194.2933
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity NONE

Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:55:15 GMT 2025
Edited
by admin
on Mon Mar 31 20:55:15 GMT 2025
Record UNII
TD4E39628G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EMILIUM CATION
Preferred Name English
EMILIUM
Common Name English
BENZENEMETHANAMINIUM, N-ETHYL-3-METHOXY-N,N-DIMETHYL-
Systematic Name English
EMILIUM ION
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00196816
Created by admin on Mon Mar 31 20:55:15 GMT 2025 , Edited by admin on Mon Mar 31 20:55:15 GMT 2025
PRIMARY
CAS
46338-61-8
Created by admin on Mon Mar 31 20:55:15 GMT 2025 , Edited by admin on Mon Mar 31 20:55:15 GMT 2025
PRIMARY
FDA UNII
TD4E39628G
Created by admin on Mon Mar 31 20:55:15 GMT 2025 , Edited by admin on Mon Mar 31 20:55:15 GMT 2025
PRIMARY
PUBCHEM
9976107
Created by admin on Mon Mar 31 20:55:15 GMT 2025 , Edited by admin on Mon Mar 31 20:55:15 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY