CID 97486

2496-15-3

Structural Information

Molecular Formula

C₁₄H₁₅N₃O

SMILES

CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)O

InChI

InChI=1S/C14H15N3O/c1-17(2)13-7-3-11(4-8-13)15-16-12-5-9-14(18)10-6-12/h3-10,18H,1-2H3

InChIKey

CQKQINNUKSBEQR-UHFFFAOYSA-N

Compound name

4-[[4-(dimethylamino)phenyl]diazenyl]phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 445
Patents: 241.1215 Da
Monoisotopic Mass: 4.2
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]+	242.12878	153.6
[M+Na]+	264.11072	160.4
[M-H]-	240.11422	163.4
[M+NH4]+	259.15532	171.6
[M+K]+	280.08466	158.7
[M+H-H2O]+	224.11876	144.9
[M+HCOO]-	286.11970	183.5
[M+CH3COO]-	300.13535	205.7
[M+Na-2H]-	262.09617	161.1
[M]+	241.12095	155.1
[M]-	241.12205	155.1

Literature stripe

literature stripe

Patent stripe

patents stripe