CID 105415

67338-60-7

Structural Information

Molecular Formula

C₁₁H₉NO₃

SMILES

C1=CC2=C(C=CC(=C2O)C(=O)O)C(=C1)N

InChI

InChI=1S/C11H9NO3/c12-9-3-1-2-7-6(9)4-5-8(10(7)13)11(14)15/h1-5,13H,12H2,(H,14,15)

InChIKey

FTFXTBBEMSWGHU-UHFFFAOYSA-N

Compound name

5-amino-1-hydroxynaphthalene-2-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 218
Patents: 203.05824 Da
Monoisotopic Mass: 2.2
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]+	204.06552	140.3
[M+Na]+	226.04746	149.2
[M-H]-	202.05096	142.6
[M+NH4]+	221.09206	158.9
[M+K]+	242.02140	145.6
[M+H-H2O]+	186.05550	134.9
[M+HCOO]-	248.05644	161.3
[M+CH3COO]-	262.07209	184.0
[M+Na-2H]-	224.03291	145.8
[M]+	203.05769	138.5
[M]-	203.05879	138.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe