CID 135408605

4569-77-1

Structural Information

Molecular Formula

C₁₂H₉N₃O

SMILES

C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)O)N

InChI

InChI=1S/C12H9N3O/c13-7-5-10-11(6-12(7)16)15-9-4-2-1-3-8(9)14-10/h1-6,16H,13H2

InChIKey

AJIRUIWLEVHQMU-UHFFFAOYSA-N

Compound name

3-aminophenazin-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 113
Patents: 211.07455 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]+	212.08183	143.3
[M+Na]+	234.06377	159.8
[M+NH4]+	229.10837	152.5
[M+K]+	250.03771	152.1
[M-H]-	210.06727	146.8
[M+Na-2H]-	232.04922	151.8
[M]+	211.07400	146.8
[M]-	211.07510	146.8

Literature stripe

literature stripe

Patent stripe

patents stripe