CID 54461807

106-420-1

Structural Information

Molecular Formula

C₁₁H₁₀N₂O

SMILES

C1=CC=C2C(=C1)C=CC=C2C(=NO)N

InChI

InChI=1S/C11H10N2O/c12-11(13-14)10-7-3-5-8-4-1-2-6-9(8)10/h1-7,14H,(H2,12,13)

InChIKey

XCCXRWMQIFDSFC-UHFFFAOYSA-N

Compound name

N'-hydroxynaphthalene-1-carboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 49
Patents: 186.07932 Da
Monoisotopic Mass: 2.7
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]+	187.08660	137.0
[M+Na]+	209.06854	144.4
[M-H]-	185.07204	141.3
[M+NH4]+	204.11314	157.0
[M+K]+	225.04248	141.2
[M+H-H2O]+	169.07658	130.7
[M+HCOO]-	231.07752	161.8
[M+CH3COO]-	245.09317	186.5
[M+Na-2H]-	207.05399	145.3
[M]+	186.07877	134.5
[M]-	186.07987	134.5

Literature stripe

literature stripe

Patent stripe

patents stripe