CID 273755

33721-67-4

Structural Information

Molecular Formula

C₁₄H₁₀N₂O

SMILES

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

InChI

InChI=1S/C14H10N2O/c15-9-11-5-7-13(8-6-11)16-10-12-3-1-2-4-14(12)17/h1-8,10,17H

InChIKey

MCPDIZHVMWCVAM-UHFFFAOYSA-N

Compound name

4-[(2-hydroxyphenyl)methylideneamino]benzonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 18
Patents: 222.07932 Da
Monoisotopic Mass: 2.8
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]+	223.08660	154.0
[M+Na]+	245.06854	167.8
[M+NH4]+	240.11314	159.2
[M+K]+	261.04248	156.5
[M-H]-	221.07204	151.6
[M+Na-2H]-	243.05399	160.7
[M]+	222.07877	154.5
[M]-	222.07987	154.5

Literature stripe

literature stripe

Patent stripe

patents stripe