CID 6844

1-hydroxy-2-naphthoic acid

Structural Information

Molecular Formula

C₁₁H₈O₃

SMILES

C1=CC=C2C(=C1)C=CC(=C2O)C(=O)O

InChI

InChI=1S/C11H8O3/c12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h1-6,12H,(H,13,14)

InChIKey

SJJCQDRGABAVBB-UHFFFAOYSA-N

Compound name

1-hydroxynaphthalene-2-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 110
References: 33601
Patents: 188.04735 Da
Monoisotopic Mass: 2.6
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]+	189.05463	136.8
[M+Na]+	211.03657	150.4
[M+NH4]+	206.08117	145.3
[M+K]+	227.01051	144.5
[M-H]-	187.04007	138.5
[M+Na-2H]-	209.02202	143.2
[M]+	188.04680	139.1
[M]-	188.04790	139.1

Literature stripe

literature stripe

Patent stripe

patents stripe