CID 16325

Sudan orange g

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

3
Annotation Hits: 4
References: 4014
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	145.8
[M+Na]+	237.06345	159.5
[M+NH4]+	232.10805	154.4
[M+K]+	253.03739	152.3
[M-H]-	213.06695	151.4
[M+Na-2H]-	235.04890	156.0
[M]+	214.07368	149.3
[M]-	214.07478	149.3

Literature stripe

literature stripe

Patent stripe

patents stripe