CID 9286

Phenazine methosulfate

Structural Information

Molecular Formula

C₁₃H₁₁N₂

SMILES

C[N+]1=C2C=CC=CC2=NC3=CC=CC=C31

InChI

InChI=1S/C13H11N2/c1-15-12-8-4-2-6-10(12)14-11-7-3-5-9-13(11)15/h2-9H,1H3/q+1

InChIKey

KBZALDXXIMXRBJ-UHFFFAOYSA-N

Compound name

5-methylphenazin-5-ium

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 725
References: 15010
Patents: 195.09222 Da
Monoisotopic Mass: 2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	196.09950	137.6
[M+Na]+	218.08144	158.1
[M+NH4]+	213.12604	149.4
[M+K]+	234.05538	149.2
[M-H]-	194.08494	143.7
[M+Na-2H]-	216.06689	149.1
[M]+	195.09167	143.0
[M]-	195.09277	143.0

Literature stripe

literature stripe

Patent stripe

patents stripe