CID 76138

1-phenazinamine

Structural Information

Molecular Formula

C₁₂H₉N₃

SMILES

C1=CC=C2C(=C1)N=C3C=CC=C(C3=N2)N

InChI

InChI=1S/C12H9N3/c13-8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-7H,13H2

InChIKey

QWUFXJHVFNRNCU-UHFFFAOYSA-N

Compound name

phenazin-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 371
Patents: 195.07965 Da
Monoisotopic Mass: 2.0
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]+	196.086926	139.1
[M+Na]+	218.068868	150.3
[M-H]-	194.072374	142.1
[M+NH4]+	213.113473	157.7
[M+K]+	234.042808	144.8
[M+H-H2O]+	178.076910	131.0
[M+HCOO]-	240.077851	161.5
[M+CH3COO]-	254.093501	152.5
[M+Na-2H]-	216.054316	151.3
[M]+	195.07910142	139.2
[M]-	195.08019858	139.2

Literature stripe

literature stripe

Patent stripe

patents stripe