CID 127824

Salicylazobenzoic acid

Structural Information

Molecular Formula

C₁₄H₁₀N₂O₅

SMILES

C1=CC(=CC=C1C(=O)O)N=NC2=CC(=C(C=C2)O)C(=O)O

InChI

InChI=1S/C14H10N2O5/c17-12-6-5-10(7-11(12)14(20)21)16-15-9-3-1-8(2-4-9)13(18)19/h1-7,17H,(H,18,19)(H,20,21)

InChIKey

JNVGBRQYZHTBTP-UHFFFAOYSA-N

Compound name

5-[(4-carboxyphenyl)diazenyl]-2-hydroxybenzoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 148
Patents: 286.05896 Da
Monoisotopic Mass: 3.3
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]+	287.06624	162.3
[M+Na]+	309.04818	173.1
[M+NH4]+	304.09278	167.5
[M+K]+	325.02212	169.2
[M-H]-	285.05168	164.7
[M+Na-2H]-	307.03363	168.7
[M]+	286.05841	164.0
[M]-	286.05951	164.0

Literature stripe

literature stripe

Patent stripe

patents stripe