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Details

Stereochemistry ACHIRAL
Molecular Formula C14H11N4.CH3O4S
Molecular Weight 346.361
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Acridinium, 3-azido-10-methyl-, methyl sulfate

SMILES

COS([O-])(=O)=O.C[N+]1=C2C=CC=CC2=CC3=CC=C(C=C13)N=[N+]=[N-]

InChI

InChIKey=UBHCXXFCLGHHIH-UHFFFAOYSA-M
InChI=1S/C14H11N4.CH4O4S/c1-18-13-5-3-2-4-10(13)8-11-6-7-12(16-17-15)9-14(11)18;1-5-6(2,3)4/h2-9H,1H3;1H3,(H,2,3,4)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C14H11N4
Molecular Weight 235.2639
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula CH3O4S
Molecular Weight 111.097
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:14:14 GMT 2025
Edited
by admin
on Tue Apr 01 20:14:14 GMT 2025
Record UNII
6HF66A9NSC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-141651
Preferred Name English
Acridinium, 3-azido-10-methyl-, methyl sulfate
Systematic Name English
Acridinium, 3-azido-10-methyl-, methyl sulfate (1:1)
Systematic Name English
Code System Code Type Description
CAS
34947-26-7
Created by admin on Tue Apr 01 20:14:14 GMT 2025 , Edited by admin on Tue Apr 01 20:14:14 GMT 2025
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NSC
141651
Created by admin on Tue Apr 01 20:14:14 GMT 2025 , Edited by admin on Tue Apr 01 20:14:14 GMT 2025
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EPA CompTox
DTXSID60188494
Created by admin on Tue Apr 01 20:14:14 GMT 2025 , Edited by admin on Tue Apr 01 20:14:14 GMT 2025
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PUBCHEM
150773
Created by admin on Tue Apr 01 20:14:14 GMT 2025 , Edited by admin on Tue Apr 01 20:14:14 GMT 2025
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FDA UNII
6HF66A9NSC
Created by admin on Tue Apr 01 20:14:14 GMT 2025 , Edited by admin on Tue Apr 01 20:14:14 GMT 2025
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