CID 16325

2,4-dihydroxyazobenzene

Structural Information

Molecular Formula

C₁₂H₁₀N₂O₂

SMILES

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

InChI

InChI=1S/C12H10N2O2/c15-10-6-7-11(12(16)8-10)14-13-9-4-2-1-3-5-9/h1-8,15-16H

InChIKey

BPTKLSBRRJFNHJ-UHFFFAOYSA-N

Compound name

4-phenyldiazenylbenzene-1,3-diol

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 4
References: 4707
Patents: 214.07423 Da
Monoisotopic Mass: 3.0
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]+	215.08151	143.4
[M+Na]+	237.06345	151.4
[M-H]-	213.06695	150.8
[M+NH4]+	232.10805	161.5
[M+K]+	253.03739	148.4
[M+H-H2O]+	197.07149	135.9
[M+HCOO]-	259.07243	171.3
[M+CH3COO]-	273.08808	190.8
[M+Na-2H]-	235.04890	152.0
[M]+	214.07368	143.3
[M]-	214.07478	143.3

Literature stripe

literature stripe

Patent stripe

patents stripe