CID 961224

75273-88-0

Structural Information

Molecular Formula

C₁₂H₁₀N₂O

SMILES

C1=CC(=CC=C1N=CC2=CC=NC=C2)O

InChI

InChI=1S/C12H10N2O/c15-12-3-1-11(2-4-12)14-9-10-5-7-13-8-6-10/h1-9,15H

InChIKey

QYVNJDMBLPNKES-UHFFFAOYSA-N

Compound name

4-(pyridin-4-ylmethylideneamino)phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 198.07932 Da
Monoisotopic Mass: 1.8
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]+	199.086596	141.2
[M+Na]+	221.068538	149.2
[M-H]-	197.072044	146.8
[M+NH4]+	216.113143	158.6
[M+K]+	237.042478	145.4
[M+H-H2O]+	181.076580	133.1
[M+HCOO]-	243.077521	166.5
[M+CH3COO]-	257.093171	185.1
[M+Na-2H]-	219.053986	150.2
[M]+	198.07877142	140.4
[M]-	198.07986858	140.4

Literature stripe

literature stripe

Patent stripe

patents stripe