CID 15957526

Phenazine, 1,6-dimethoxy-, 5-oxide

Structural Information

Molecular Formula

C₁₄H₁₂N₂O₃

SMILES

COC1=CC=CC2=C1[N+](=C3C=CC=C(C3=N2)OC)[O-]

InChI

InChI=1S/C14H12N2O3/c1-18-11-7-4-6-10-13(11)15-9-5-3-8-12(19-2)14(9)16(10)17/h3-8H,1-2H3

InChIKey

YJPUKVVGBLRGID-UHFFFAOYSA-N

Compound name

1,6-dimethoxy-5-oxidophenazin-5-ium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 3
Patents: 256.08478 Da
Monoisotopic Mass: 1.6
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]+	257.09206	154.1
[M+Na]+	279.07400	173.0
[M+NH4]+	274.11860	163.3
[M+K]+	295.04794	166.8
[M-H]-	255.07750	158.2
[M+Na-2H]-	277.05945	162.1
[M]+	256.08423	158.2
[M]-	256.08533	158.2

Literature stripe

literature stripe

Patent stripe

patents stripe